Full Regression: serial — 2026-09-03T04-51-23Z_d71abe6102

Configuration: 1 process · compared with the other configurations at this commit

721

Tests

451

Passed

Failed

Errors

124

Runtest

Skipped

124 test(s) are runtests. A "runtest" ran to completion but could not be checked against anything - there is no reference log file, or the run was a "-skiprun" dry run - so only the run itself was tested: it is neither passed nor skipped, and counted apart from both. What each of them lacks is counted under not really tested below.

title	Full Regression Test / Serial
sha	d71abe6102c44577442ba7f03b7378a83166b9fd
branch	develop
version	patch_2Sep2026
generated	2026-09-03T04:51:23Z
source_url	https://download.lammps.org/coverage/serial.json
operating_system	OS: Linux "Fedora Linux 44 (Forty Four)" 7.1.8-200.fc44.x86_64 x86_64
git_info	Git info (develop / patch_2Sep2026)
compiler	Compiler: Clang C++ Clang 22.1.8 (Fedora 22.1.8-4.fc44) with OpenMP 5.1
compile_flags	-DLAMMPS_GZIP -DLAMMPS_PNG -DLAMMPS_JPEG -DLAMMPS_FFMPEG -DLAMMPS_CURL -DLAMMPS_SMALLBIG
config_file	config_serial.yaml
lmp_binary	/home/akohlmey/compile/lammps-analyze/build-regression/lmp

Changes vs 2026-09-02T21-42-14Z_9f04213aff

4 new tests · 12 removed vs previous run

New tests (4)

PACKAGES/mbx/256h2o/in.mbx_h2o
PACKAGES/mbx/256h2o_dipole/in.mbx_h2o
PACKAGES/mbx/mof_ff_lammps+1_h2o_mbx/in.mbx_mof_1h2o
PACKAGES/mbx/na+_slab/in.slab

Removed tests (12)

PACKAGES/mbx/256h2o/in.256h2o
PACKAGES/mbx/256h2o_dipole/in.256h2o_dipole
PACKAGES/mbx/mof_ff_lammps+1_h2o_mbx/in.mof_1h2o
PACKAGES/mbx/na+_slab/in.na+_slab
PACKAGES/symmetry/in.lj_binary_fcc_pinv
PACKAGES/symmetry/in.lj_diamond_pinv
PACKAGES/symmetry/in.lj_fcc_pinv
PACKAGES/symmetry/in.lj_pinv
PACKAGES/symmetry/in.lj_pm_wyckoff
PACKAGES/symmetry/in.sic_c2
mc/in.gcmc.region
rigid/in.rigid.small.kk

Needs a fix in the examples tree (109)

Problems with the input scripts rather than with the code. These stay until somebody edits the example, and they are reported independently of the verdict, so a test that passes can carry one.

production sized run (83)

ASPHERE/line/in.line.srd
the run needs 65 s: a production sized run that should be shortened in the repository
ASPHERE/tri/in.tri.srd
the run needs 147 s: a production sized run that should be shortened in the repository
PACKAGES/addtorque_group/in.addtorque
the run needs 75 s: a production sized run that should be shortened in the repository
PACKAGES/diffraction/in.BulkNi
the run needs 178 s: a production sized run that should be shortened in the repository
PACKAGES/dpd-meso/edpd/in.edpd
the run needs 95 s: a production sized run that should be shortened in the repository
PACKAGES/dpd-meso/edpd/in.edpd-region
the run needs 96 s: a production sized run that should be shortened in the repository
PACKAGES/dpd-meso/mdpd/in.mdpd
the run needs 109 s: a production sized run that should be shortened in the repository
PACKAGES/dpd-meso/tdpd/in.tdpd
the run needs 75 s: a production sized run that should be shortened in the repository
PACKAGES/dpd-meso/tdpd/in.tdpd-region
the run needs 81 s: a production sized run that should be shortened in the repository
PACKAGES/drude/butane/in.butane.lang
the run needs 61 s: a production sized run that should be shortened in the repository
PACKAGES/drude/butane/in.butane.nh
the run needs 61 s: a production sized run that should be shortened in the repository
PACKAGES/drude/ethanol/in.ethanol.tgnh
the run needs 63 s: a production sized run that should be shortened in the repository
PACKAGES/drude/swm4-ndp/in.swm4-ndp.lang
the run needs 88 s: a production sized run that should be shortened in the repository
PACKAGES/drude/swm4-ndp/in.swm4-ndp.nh
the run needs 74 s: a production sized run that should be shortened in the repository
PACKAGES/drude/toluene/in.toluene.lang
the run needs 87 s: a production sized run that should be shortened in the repository
PACKAGES/drude/toluene/in.toluene.nh
the run needs 89 s: a production sized run that should be shortened in the repository
PACKAGES/eff/Auger-Adamantane/in.adamantane_ionized.nve
the run needs 107 s: a production sized run that should be shortened in the repository
PACKAGES/eff/H_plasma/in.h2bulk.npt
the run needs 64 s: a production sized run that should be shortened in the repository
PACKAGES/eff/H_plasma/in.h2bulk.nve
the run needs 96 s: a production sized run that should be shortened in the repository
PACKAGES/eff/H_plasma/in.h2bulk.nve.ang
the run needs 98 s: a production sized run that should be shortened in the repository
PACKAGES/eff/Li-dendritic/in.Li-dendritic.nvt
the run needs 87 s: a production sized run that should be shortened in the repository
PACKAGES/eff/Li-solid/in.Li.bohr
the run needs 60 s: a production sized run that should be shortened in the repository
PACKAGES/electrode/graph-il/in.graph-il-conp
the run needs 71 s: a production sized run that should be shortened in the repository
PACKAGES/electrode/graph-il/in.graph-il-conq
the run needs 65 s: a production sized run that should be shortened in the repository
PACKAGES/electrode/graph-il/in.graph-il-conq2
the run needs 70 s: a production sized run that should be shortened in the repository
PACKAGES/electrode/graph-il/in.graph-il-etypes
the run needs 64 s: a production sized run that should be shortened in the repository
PACKAGES/electrode/graph-il/in.graph-il-ffield
the run needs 69 s: a production sized run that should be shortened in the repository
PACKAGES/electrode/graph-il/in.graph-il-ramp
the run needs 62 s: a production sized run that should be shortened in the repository
PACKAGES/electrode/graph-il/in.graph-il-thermo
the run needs 69 s: a production sized run that should be shortened in the repository
PACKAGES/filter_corotate/in.peptide
the run needs 113 s: a production sized run that should be shortened in the repository
PACKAGES/hma/in.hma
the run needs 90 s: a production sized run that should be shortened in the repository
PACKAGES/ilves/in.covid
the run needs 123 s: a production sized run that should be shortened in the repository
PACKAGES/ilves/in.rhodo-allbonds
the run needs 73 s: a production sized run that should be shortened in the repository
PACKAGES/ilves/in.rhodo-ilves
the run needs 66 s: a production sized run that should be shortened in the repository
PACKAGES/ilves/in.rhodo-shake
the run needs 63 s: a production sized run that should be shortened in the repository
PACKAGES/interlayer/ilp_graphene_hbn/in.bilayer-graphene
the run needs 89 s: a production sized run that should be shortened in the repository
PACKAGES/interlayer/ilp_graphene_hbn/in.bilayer-hBN
the run needs 97 s: a production sized run that should be shortened in the repository
PACKAGES/interlayer/ilp_graphene_hbn/in.grhBN
the run needs 91 s: a production sized run that should be shortened in the repository
PACKAGES/interlayer/ilp_graphene_hbn/in.ilp_graphene_hbn
the run needs 96 s: a production sized run that should be shortened in the repository
PACKAGES/interlayer/ilp_tmds/in.mos2
the run needs 76 s: a production sized run that should be shortened in the repository
PACKAGES/interlayer/kolmogorov_crespi_full/in.bilayer-graphene
the run needs 86 s: a production sized run that should be shortened in the repository
PACKAGES/interlayer/saip_metal_tmd/in.au_mos2
the run needs 85 s: a production sized run that should be shortened in the repository
PACKAGES/latboltz/pit_geometry/in.pits
the run needs 175 s: a production sized run that should be shortened in the repository
PACKAGES/local_density/methanol_implicit_water/in.methanol_implicit_water
the run needs 81 s: a production sized run that should be shortened in the repository
PACKAGES/mbx/256h2o/in.mbx_h2o
the run needs 79 s: a production sized run that should be shortened in the repository; no reference log file matches this input, while log.21Jul26.256h2o.g++.1 in this folder match no input script at ...
PACKAGES/mbx/256h2o_dipole/in.mbx_h2o
the run needs 84 s: a production sized run that should be shortened in the repository; no reference log file matches this input, while log.21Jul26.256h2o_dipole.g++.1 in this folder match no input scr ...
PACKAGES/mbx/na+_slab/in.slab
the run needs 193 s: a production sized run that should be shortened in the repository; no reference log file matches this input, while log.21Jul26.na+_slab.g++.1 in this folder match no input script ...
PACKAGES/meam_spline/in.meam-spline.TiO2
the run needs 101 s: a production sized run that should be shortened in the repository
PACKAGES/meam_sw_spline/Ti/in.energy_conservation.meam.sw
the run needs 94 s: a production sized run that should be shortened in the repository
PACKAGES/neighbor-swap/in.KMC_pulse_center
the run needs 73 s: a production sized run that should be shortened in the repository
... and 33 more

reference log file matches no input (29)

PACKAGES/dpd-smooth/2d-diffusion-in-shear-flow/in.lammps
no reference log file matches this input, while log.28Mar23.2d-diffusion-in-shear-flow.g++.1, log.28Mar23.2d-diffusion-in-shear-flow.g++.4 in this folder match no input script at all: check the names
PACKAGES/dpd-smooth/2d-diffusion/in.lammps
no reference log file matches this input, while log.28Mar23.2d-diffusion.g++.1, log.28Mar23.2d-diffusion.g++.4 in this folder match no input script at all: check the names
PACKAGES/dpd-smooth/equipartition-verification/in.lammps
no reference log file matches this input, while log.28Mar23.equipartition.g++.1, log.28Mar23.equipartition.g++.4 in this folder match no input script at all: check the names
PACKAGES/eff/fixed-core/C2H6/in.C2H6fc.bohr
no reference log file matches this input, while log.C2H6fc.ang.smoke.1 in this folder match no input script at all: check the names
PACKAGES/eff/fixed-core/CH4/in.CH4fc.ang
no reference log file matches this input, while log.CH4fc.spe.bohr.1 in this folder match no input script at all: check the names
PACKAGES/eff/fixed-core/CH4/in.CH4fc.bohr
no reference log file matches this input, while log.CH4fc.ang.smoke.1, log.CH4fc.spe.ang.1, log.CH4fc.spe.bohr.1 in this folder match no input script at all: check the names
PACKAGES/eff/fixed-core/CH4/in.CH4fc.spe.ang
no reference log file matches this input, while log.CH4fc.ang.smoke.1, log.CH4fc.spe.bohr.1 in this folder match no input script at all: check the names
PACKAGES/mbx/256h2o/in.mbx_h2o
the run needs 79 s: a production sized run that should be shortened in the repository; no reference log file matches this input, while log.21Jul26.256h2o.g++.1 in this folder match no input script at ...
PACKAGES/mbx/256h2o_dipole/in.mbx_h2o
the run needs 84 s: a production sized run that should be shortened in the repository; no reference log file matches this input, while log.21Jul26.256h2o_dipole.g++.1 in this folder match no input scr ...
PACKAGES/mbx/mof_ff_lammps+1_h2o_mbx/in.mbx_mof_1h2o
no reference log file matches this input, while log.21Jul26.mof.g++.1 in this folder match no input script at all: check the names
PACKAGES/mbx/na+_slab/in.slab
the run needs 193 s: a production sized run that should be shortened in the repository; no reference log file matches this input, while log.21Jul26.na+_slab.g++.1 in this folder match no input script ...
balance/in.balance
no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
balance/in.balance.bond.fast
no reference log file matches this input, while log.balance.bond.slow.smoke.1, log.balance.clock.static.smoke.1, log.balance.group.static.smoke.1, ... in this folder match no input script at all: chec ...
balance/in.balance.bond.slow
no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
balance/in.balance.clock.dynamic
no reference log file matches this input, while log.balance.bond.fast.smoke.1, log.balance.bond.slow.smoke.1, log.balance.clock.static.smoke.1, ... in this folder match no input script at all: check t ...
balance/in.balance.clock.static
no reference log file matches this input, while log.balance.neigh.dynamic.smoke.1, log.balance.neigh.static.smoke.1 in this folder match no input script at all: check the names
balance/in.balance.group.dynamic
no reference log file matches this input, while log.balance.bond.slow.smoke.1, log.balance.clock.static.smoke.1, log.balance.group.static.smoke.1, ... in this folder match no input script at all: chec ...
balance/in.balance.group.static
no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
balance/in.balance.kspace
no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.neigh.dynamic.smoke.1, log.balance.neigh.static.smoke.1 in this folder match no input script at all: check ...
balance/in.balance.neigh.dynamic
no reference log file matches this input, while log.balance.neigh.static.smoke.1 in this folder match no input script at all: check the names
balance/in.balance.neigh.rcb
no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
balance/in.balance.var.dynamic
no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
hyper/in.hyper.local
no reference log file matches this input, while log.hyper.global.smoke.1 in this folder match no input script at all: check the names
mc/in.mixed
no reference log file matches this input, while log.24Nov25.gemc.lj.0.g++.5, log.24Nov25.gemc.lj.1.g++.5, log.hmc.flexible.melt.1 in this folder match no input script at all: check the names
mc/in.pure
no reference log file matches this input, while log.24Nov25.gemc.lj.0.g++.5, log.24Nov25.gemc.lj.1.g++.5, log.hmc.flexible.melt.1 in this folder match no input script at all: check the names
rigid/in.rigid.cubes.multirun
no reference log file matches this input, while log.rigid.cubes.gravity.1, log.rigid.cubes.langevin.1, log.rigid.cubes.npt.1, ... in this folder match no input script at all: check the names
snap/in.snap.grid
no reference log file matches this input, while log.15Jun22.grid.snap.g++.1, log.15Jun22.grid.snap.g++.4, log.15Jun22.grid.tri.g++.1, ... in this folder match no input script at all: check the names
snap/in.snap.grid.triclinic
no reference log file matches this input, while log.15Jun22.grid.snap.g++.1, log.15Jun22.grid.snap.g++.4, log.15Jun22.grid.tri.g++.1, ... in this folder match no input script at all: check the names
snap/in.snap.scale.Ni_Zuo_JCPA2020
no reference log file matches this input, while log.15Jun22.grid.snap.g++.1, log.15Jun22.grid.snap.g++.4, log.15Jun22.grid.tri.g++.1, ... in this folder match no input script at all: check the names

Worth investigating (25)

A classical MD trajectory is chaotic, so a difference that appears late says nothing about the code, while one that is there in the first thermo output cannot be rounding. Inputs that cannot match their reference log file are listed above instead.

Differs before the trajectory can diverge (1)

python/in.pair_python_coulomb
differs in the very first thermo output

Differs within the first 200 steps (24)

PACKAGES/baoab/in.baoab_lj
differs from step 200 on (output row 13)
PACKAGES/dpd-basic/dpd/in.dpd
differs from step 100 on (output row 1)
PACKAGES/drude/butane/in.butane.tgnh
differs from step 150 on (output row 3)
PACKAGES/drude/ethanol/in.ethanol.lang
differs from step 60 on (output row 3)
PACKAGES/drude/ethanol/in.ethanol.nh
differs from step 60 on (output row 3)
PACKAGES/drude/ethylene_glycol/in.ethylene_glycol
differs from step 50 on (output row 1)
PACKAGES/extep/in.extep-bn
differs from step 20 on (output row 2)
PACKAGES/grem/lj-single/in.gREM-npt
differs from step 10 on (output row 1)
PACKAGES/interlayer/drip/in.CH_drip
differs from step 40 on (output row 4)
PACKAGES/machdyn/rubber_rings_3d/in.rubber_rings_3d
differs from step 100 on (output row 1)
SPIN/test_problems/validation_nvt/in.spin.nvt_lattice
differs from step 200 on (output row 1)
charmmfsw/in.charmmfsw
differs from step 20 on (output row 2)
coreshell/in.coreshell
differs from step 100 on (output row 2)
coreshell/in.coreshell.thermostats
differs from step 100 on (output row 2)
coreshell/in.coreshell.wolf
differs from step 50 on (output row 1)
eim/in.eim
differs from step 50 on (output row 1)
mc/in.hmc.rigid
differs from step 100 on (output row 1)
micelle/in.micelle-rigid
differs from step 50 on (output row 12)
rigid/in.rigid.nve
differs from step 50 on (output row 1)
rigid/in.rigid.nve.early
differs from step 50 on (output row 1)
template/in.mol-data-mix
differs from step 200 on (output row 2)
template/in.molecular-mix
differs from step 190 on (output row 2)
template/in.template-mix
differs from step 190 on (output row 2)
template/in.tmpl-data-mix
differs from step 200 on (output row 2)

Differs after 200 to 1000 steps (29)

ASPHERE/box/in.box
differs from step 1000 on (output row 12)
ASPHERE/box/in.box.mp
differs from step 1000 on (output row 12)
ASPHERE/dimer/in.dimer
differs from step 1000 on (output row 12)
ASPHERE/dimer/in.dimer.mp
differs from step 1000 on (output row 12)
ASPHERE/line/in.line
differs from step 1000 on (output row 1)
ASPHERE/star/in.star
differs from step 1000 on (output row 12)
ASPHERE/star/in.star.mp
differs from step 1000 on (output row 12)
PACKAGES/bocs/in.methanol
differs from step 500 on (output row 1)
PACKAGES/dpd-basic/dpd_coul_slater_long/in.dpd_coul_slater_long
differs from step 500 on (output row 5)
PACKAGES/interlayer/aip_water_2dm/in.gr_water.opt
differs from step 1000 on (output row 10)
PACKAGES/manybody_table/in.spce
differs from step 400 on (output row 4)
PACKAGES/manybody_table/in.spce2
differs from step 400 on (output row 4)
PACKAGES/manybody_table/in.spce_sw
differs from step 900 on (output row 9)
PACKAGES/pedone/in.pedone.melt
differs from step 600 on (output row 6)
PACKAGES/qtb/alpha_quartz_qtb/in.alpha_quartz_qtb
differs from step 1000 on (output row 2)
PACKAGES/reaction/create_atoms_polystyrene/in.grow_styrene
differs from step 500 on (output row 5)
PACKAGES/reaction/tiny_nylon/in.tiny_nylon.stabilized
differs from step 550 on (output row 11)
PACKAGES/reaction/tiny_nylon_json/in.tiny_nylon.stabilized
differs from step 550 on (output row 11)
PACKAGES/reaction/tiny_nylon_wildcards/in.tiny_nylon.stabilized
differs from step 550 on (output row 11)
PACKAGES/shock/nemd/in.nemd
differs from step 800 on (output row 12)
body/in.cubes
differs from step 1000 on (output row 1)
body/in.squares
differs from step 1000 on (output row 1)
body/in.wall2d
differs from step 1000 on (output row 1)
granregion/in.granregion.box
differs from step 400 on (output row 4)
micelle/in.micelle
differs from step 850 on (output row 38)
python/in.pair_python_hybrid
differs from step 350 on (output row 8)
python/in.pair_python_melt
differs from step 350 on (output row 8)
srd/in.srd.mixture
differs from step 800 on (output row 10)
template/in.hybrid
differs from step 400 on (output row 4)

Differs only after 1000 steps, consistent with chaos (13)

ASPHERE/flat_membrane/in.flat_membrane
differs from step 1600 on (output row 8)
PACKAGES/cauchy/in.cauchystat
differs from step 1800 on (output row 19)
PACKAGES/gle/in.h2o-quantum
differs from step 1500 on (output row 15)
PACKAGES/gle/in.h2o-smart
differs from step 3300 on (output row 33)
PACKAGES/reaction/tiny_polystyrene/in.tiny_polystyrene.stabilized
differs from step 10000 on (output row 1), but the thermo output is too sparse to tell when it started
SPIN/test_problems/validation_nve/in.spin.iron-nve
differs from step 6400 on (output row 32)
cmap/in.cmap
differs from step 10000 on (output row 10)
colloid/in.colloid
differs from step 6000 on (output row 6)
ellipse/in.ellipse.gayberne
differs from step 2400 on (output row 25)
ellipse/in.ellipse.resquared
differs from step 2900 on (output row 30)
meam/in.meam.shear
differs from step 1600 on (output row 21)
mesh/in.mesh_box
differs from step 1400 on (output row 8)
rigid/in.rigid.tnr
differs from step 5800 on (output row 59)

Not really tested (172)

A "runtest" ran to completion but could not be checked against anything - there is no reference log file, or the run was a "-skiprun" dry run - so only the run itself was tested: it is neither passed nor skipped, and counted apart from both.

◉ runtest – Ran to completion, but nothing could be checked (124)

59	no reference log file, run as a crash test
26	no reference log file, not shortened
23	log file could not be parsed
16	no thermo output to compare

○ skipped – Not run at all (48)

26	needs a multi-partition run
22	excluded by the test configuration

All tests

Status	Test	Time (s)	Details
✗ failed	`ASPHERE/box/in.box`	28.8	completed, 2 abs diff and 3 rel diff checks failed differs from step 1000 on (output row 12)
✗ failed	`ASPHERE/box/in.box.mp`	27.2	completed, 3 abs diff and 3 rel diff checks failed differs from step 1000 on (output row 12)
✗ failed	`ASPHERE/dimer/in.dimer`	9.4	completed, 3 abs diff and 3 rel diff checks failed differs from step 1000 on (output row 12)
✗ failed	`ASPHERE/dimer/in.dimer.mp`	20.7	completed, 3 abs diff and 3 rel diff checks failed differs from step 1000 on (output row 12)
✓ passed	`ASPHERE/ellipsoid/in.ellipsoid`	14.1
✓ passed	`ASPHERE/ellipsoid/in.ellipsoid.mp`	14.6
✗ failed	`ASPHERE/flat_membrane/in.flat_membrane`	9.5	completed, 1 abs diff and 2 rel diff checks failed differs from step 1600 on (output row 8)
✗ failed	`ASPHERE/line/in.line`	4.1	completed, 2 abs diff and 2 rel diff checks failed differs from step 1000 on (output row 1)
✗ failed	`ASPHERE/line/in.line.srd`	64.5	completed, 4 abs diff and 4 rel diff checks failed differs from step 1000 on (output row 1) the run needs 65 s: a production sized run that should be shortened in the repository
✓ passed	`ASPHERE/poly/in.poly`	12.3
✓ passed	`ASPHERE/poly/in.poly.mp`	12.3
✗ failed	`ASPHERE/star/in.star`	16.4	completed, 2 abs diff and 3 rel diff checks failed differs from step 1000 on (output row 12)
✗ failed	`ASPHERE/star/in.star.mp`	17.5	completed, 3 abs diff and 3 rel diff checks failed differs from step 1000 on (output row 12)
✓ passed	`ASPHERE/superellipsoid_gran/in.bowling`	0.5
✓ passed	`ASPHERE/superellipsoid_gran/in.drop_test`	14.9
✓ passed	`ASPHERE/superellipsoid_gran/in.ellipsoid_gran`	0.7
◉ runtest	`ASPHERE/superellipsoid_gran/in.super_table`	1.2	completed, numerical checks skipped due to missing the reference log file
✗ failed	`ASPHERE/tri/in.tri.srd`	146.7	completed, 4 abs diff and 4 rel diff checks failed differs from step 100 on (output row 1) the run needs 147 s: a production sized run that should be shortened in the repository
✓ passed	`ASPHERE/vesicle/in.vesicle`	15.1
✓ passed	`LEPTON/in.efield-lepton`	2.3
✓ passed	`PACKAGES/addtorque_group/in.addtorque`	75.4	the run needs 75 s: a production sized run that should be shortened in the repository
○ skipped	`PACKAGES/alchemy/in.alloy`	0.0	skipped, needs a multi-partition run ("fix 2 all alchemy")
○ skipped	`PACKAGES/alchemy/in.twowater`	0.0	skipped, needs a multi-partition run ("fix transform all alchemy")
✗ failed	`PACKAGES/baoab/in.baoab_lj`	1.0	completed, 4 abs diff and 4 rel diff checks failed differs from step 200 on (output row 13) (last OK: 2026-07-28T00-47-56Z_73a17bb8cd)
✓ passed	`PACKAGES/bocs/1_site_just_pair_LD/in.basic_ldd`	2.2
✓ passed	`PACKAGES/bocs/4_sites_LD_SG/in.ldd_create_data`	4.1
✓ passed	`PACKAGES/bocs/4_sites_LD_SG/in.ldd_molecule`	4.4
✗ failed	`PACKAGES/bocs/in.methanol`	32.6	completed, 4 abs diff and 4 rel diff checks failed differs from step 500 on (output row 1)
✓ passed	`PACKAGES/bondval/in.hexbto`	26.5
✓ passed	`PACKAGES/brownian/2d_velocity/in.2d.velocity`	1.0
✓ passed	`PACKAGES/brownian/align_self/in.alignself_dipole`	5.7
✓ passed	`PACKAGES/brownian/align_self/in.alignself_quat`	8.7
✓ passed	`PACKAGES/brownian/asphere/in.2d.ellipsoid`	1.5
✓ passed	`PACKAGES/brownian/asphere/in.3d.ellipsoid`	1.9
✓ passed	`PACKAGES/brownian/point/in.2d.point`	1.1
✓ passed	`PACKAGES/brownian/point/in.3d.point`	1.3
✓ passed	`PACKAGES/brownian/sphere/in.2d.sphere`	1.3
✓ passed	`PACKAGES/brownian/sphere/in.3d.sphere`	1.2
✓ passed	`PACKAGES/brownian/spherical_ABP/in.2d.abp`	2.2
✓ passed	`PACKAGES/brownian/spherical_ABP/in.3d.ideal_abp`	6.4
✗ failed	`PACKAGES/cauchy/in.cauchystat`	2.8	completed, 1 abs diff and 1 rel diff checks failed differs from step 1800 on (output row 19)
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxDNA/duplex1/in.duplex1`	0.7
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxDNA/duplex2/in.duplex2`	0.6
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxDNA/potential_file/in.duplex1`	0.7
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxDNA2/dsring/in.dsring`	5.4
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxDNA2/duplex1/in.duplex1`	0.6
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxDNA2/duplex2/in.duplex2`	0.8
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxDNA2/duplex3/in.duplex3`	0.9
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxDNA2/potential_file/in.duplex1`	0.6
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxDNA3/duplex2/in.duplex2`	0.7
○ skipped	`PACKAGES/cgdna/examples/lj_units/oxDNA3/unique_bp/in.dsring2`	0.0	skipped as specified in the test configuration
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxRNA2/duplex2/in.duplex2`	0.7
✓ passed	`PACKAGES/cgdna/examples/lj_units/oxRNA2/potential_file/in.duplex2`	1.0
✓ passed	`PACKAGES/cgdna/examples/real_units/oxDNA/duplex1/in.duplex1`	0.8
✓ passed	`PACKAGES/cgdna/examples/real_units/oxDNA/duplex2/in.duplex2`	1.0
✓ passed	`PACKAGES/cgdna/examples/real_units/oxDNA/potential_file/in.duplex1`	0.6
✓ passed	`PACKAGES/cgdna/examples/real_units/oxDNA2/dsring/in.dsring`	4.7
✓ passed	`PACKAGES/cgdna/examples/real_units/oxDNA2/duplex1/in.duplex1`	0.8
✓ passed	`PACKAGES/cgdna/examples/real_units/oxDNA2/duplex2/in.duplex2`	0.8
✓ passed	`PACKAGES/cgdna/examples/real_units/oxDNA2/duplex3/in.duplex3`	0.8
✓ passed	`PACKAGES/cgdna/examples/real_units/oxDNA2/potential_file/in.duplex1`	0.9
✓ passed	`PACKAGES/cgdna/examples/real_units/oxDNA3/duplex2/in.duplex2`	1.1
○ skipped	`PACKAGES/cgdna/examples/real_units/oxDNA3/unique_bp/in.dsring2`	0.0	skipped as specified in the test configuration
✓ passed	`PACKAGES/cgdna/examples/real_units/oxRNA2/duplex2/in.duplex2`	0.8
✓ passed	`PACKAGES/cgdna/examples/real_units/oxRNA2/potential_file/in.duplex2`	0.7
✓ passed	`PACKAGES/cgspica/sds-monolayer/in.sds-hybrid`	5.9
✓ passed	`PACKAGES/cgspica/sds-monolayer/in.sds-regular`	9.3
✓ passed	`PACKAGES/charge_regulation/in.chreg-acid`	1.7
✓ passed	`PACKAGES/charge_regulation/in.chreg-acid-real`	1.6
✓ passed	`PACKAGES/charge_regulation/in.chreg-polymer`	1.4
✓ passed	`PACKAGES/class2xe/in.NVT_class2xe.script`	0.7
◉ runtest	`PACKAGES/cnp/in.cnp`	18.8	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
✓ passed	`PACKAGES/dielectric/in.confined.dof`	6.9
✓ passed	`PACKAGES/dielectric/in.confined.gmres`	1.2
✓ passed	`PACKAGES/dielectric/in.confined.icc`	1.6
✓ passed	`PACKAGES/dielectric/in.nopbc.dof`	2.5
✓ passed	`PACKAGES/dielectric/in.nopbc.gmres`	0.7
✓ passed	`PACKAGES/dielectric/in.nopbc.icc`	0.7
✓ passed	`PACKAGES/diffraction/in.BulkNi`	178.1	the run needs 178 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/dispersion/in.d2`	7.0
✓ passed	`PACKAGES/dispersion/in.d3`	12.1
✗ failed	`PACKAGES/dpd-basic/dpd/in.dpd`	1.2	completed, 2 abs diff and 2 rel diff checks failed differs from step 100 on (output row 1)
✗ failed	`PACKAGES/dpd-basic/dpd_coul_slater_long/in.dpd_coul_slater_long`	1.4	completed, 4 abs diff and 4 rel diff checks failed differs from step 500 on (output row 5) (last OK: 2026-08-27T14-10-41Z_d1c9032f71)
✓ passed	`PACKAGES/dpd-basic/dpd_tstat/in.dpd_tstat`	13.3
✗ failed	`PACKAGES/dpd-basic/dpdext/in.dpdext`	1.6	failed, thermo checks skipped due to mismatched number of steps in the log files
✓ passed	`PACKAGES/dpd-basic/dpdext_tstat/in.dpdext_tstat`	33.6
✗ failed	`PACKAGES/dpd-meso/edpd/in.edpd`	94.9	completed, 6 abs diff and 6 rel diff checks failed differs from step 100 on (output row 1) the run needs 95 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/dpd-meso/edpd/in.edpd-region`	96.3	completed, 6 abs diff and 6 rel diff checks failed differs from step 100 on (output row 1) the run needs 96 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/dpd-meso/mdpd/in.mdpd`	109.4	completed, 3 abs diff and 3 rel diff checks failed differs in the very first thermo output the run needs 109 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/dpd-meso/tdpd/in.tdpd`	75.1	the run needs 75 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/dpd-meso/tdpd/in.tdpd-region`	80.7	the run needs 81 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/dpd-react/dpd-shardlow/in.dpd-shardlow`	1.0	completed, numerical checks skipped due to missing the reference log file
◉ runtest	`PACKAGES/dpd-react/dpd-vv/in.dpd-vv`	2.0	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/dpd-react/dpde-shardlow/in.dpde-shardlow`	0.8	completed, numerical checks skipped due to missing the reference log file
◉ runtest	`PACKAGES/dpd-react/dpde-vv/in.dpde-vv`	2.0	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/dpd-react/dpdh-shardlow/in.dpdh-shardlow`	4.5	completed, numerical checks skipped due to missing the reference log file
◉ runtest	`PACKAGES/dpd-react/dpdp-shardlow/in.dpdp-shardlow`	0.9	completed, numerical checks skipped due to missing the reference log file
✓ passed	`PACKAGES/dpd-react/dpdrx-shardlow/in.dpdrx-shardlow`	1.0
◉ runtest	`PACKAGES/dpd-react/multi-lucy/in.multi-lucy`	2.2	completed, numerical checks skipped due to missing the reference log file
◉ runtest	`PACKAGES/dpd-smooth/2d-diffusion-in-shear-flow/in.lammps`	1.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.28Mar23.2d-diffusion-in-shear-flow.g++.1, log.28Mar23.2d-diffusion-in-shear-flow.g++.4 in this folder match no input script at all: check the names
◉ runtest	`PACKAGES/dpd-smooth/2d-diffusion/in.lammps`	1.2	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.28Mar23.2d-diffusion.g++.1, log.28Mar23.2d-diffusion.g++.4 in this folder match no input script at all: check the names
◉ runtest	`PACKAGES/dpd-smooth/equipartition-verification/in.lammps`	18.9	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.28Mar23.equipartition.g++.1, log.28Mar23.equipartition.g++.4 in this folder match no input script at all: check the names
✗ failed	`PACKAGES/drude/butane/in.butane.lang`	60.8	completed, 3 abs diff and 3 rel diff checks failed differs from step 100 on (output row 2) the run needs 61 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/drude/butane/in.butane.nh`	61.0	completed, 3 abs diff and 5 rel diff checks failed differs from step 150 on (output row 3) the run needs 61 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/drude/butane/in.butane.tgnh`	59.8	completed, 4 abs diff and 4 rel diff checks failed differs from step 150 on (output row 3)
✗ failed	`PACKAGES/drude/ethanol/in.ethanol.lang`	56.4	completed, 5 abs diff and 5 rel diff checks failed differs from step 60 on (output row 3)
✗ failed	`PACKAGES/drude/ethanol/in.ethanol.nh`	58.2	completed, 5 abs diff and 5 rel diff checks failed differs from step 60 on (output row 3)
✗ failed	`PACKAGES/drude/ethanol/in.ethanol.tgnh`	62.7	completed, 5 abs diff and 5 rel diff checks failed differs from step 60 on (output row 3) the run needs 63 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/drude/ethylene_glycol/in.ethylene_glycol`	26.8	completed, 4 abs diff and 4 rel diff checks failed differs from step 50 on (output row 1)
✗ failed	`PACKAGES/drude/swm4-ndp/in.swm4-ndp.lang`	88.0	completed, 5 abs diff and 5 rel diff checks failed differs from step 20 on (output row 1) the run needs 88 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/drude/swm4-ndp/in.swm4-ndp.nh`	74.1	completed, 5 abs diff and 5 rel diff checks failed differs from step 20 on (output row 1) the run needs 74 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/drude/toluene/in.toluene.lang`	87.0	completed, 5 abs diff and 5 rel diff checks failed differs from step 50 on (output row 1) the run needs 87 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/drude/toluene/in.toluene.nh`	89.5	completed, 5 abs diff and 5 rel diff checks failed differs from step 50 on (output row 1) the run needs 89 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/e3b/in.e3b-tip4p2005`	3.8
✓ passed	`PACKAGES/edip/in.edip-Si`	0.8
✓ passed	`PACKAGES/edip/in.edip-Si-multi`	0.9
✓ passed	`PACKAGES/edip/in.edip-SiC`	0.6
✓ passed	`PACKAGES/ees/in.fix_wall`	0.8
✓ passed	`PACKAGES/ees/in.fix_wall_region`	0.7
✓ passed	`PACKAGES/eff/Auger-Adamantane/in.adamantane_ionized.nve`	106.8	the run needs 107 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/eff/Be-solid/in.Be-solid.spe`	18.6	completed, numerical checks skipped due to missing the reference log file
✓ passed	`PACKAGES/eff/CH4/in.ch4.dynamics`	1.9
✓ passed	`PACKAGES/eff/CH4/in.ch4.min`	0.7
✓ passed	`PACKAGES/eff/CH4/in.ch4_ionized.dynamics`	20.7
✓ passed	`PACKAGES/eff/ECP/Si2H6/in.Si2H6`	0.6
✓ passed	`PACKAGES/eff/ECP/Si2H6/in.Si2H6.ang`	5.9
◉ runtest	`PACKAGES/eff/ECP/SiC/bulk/in.SiC`	39.8	completed, numerical checks skipped due to missing the reference log file
◉ runtest	`PACKAGES/eff/ECP/SiH4/in.SiH4`	0.6	completed, error parsing log.SiH4.1 into YAML
◉ runtest	`PACKAGES/eff/ECP/SiH4/in.SiH4.ang`	0.6	completed, error parsing log.SiH4.ang.1 into YAML
◉ runtest	`PACKAGES/eff/H/in.h_atom.spe.ang`	0.7	completed, numerical checks skipped due to missing the reference log file
◉ runtest	`PACKAGES/eff/H/in.h_atom.spe.bohr`	0.6	completed, numerical checks skipped due to missing the reference log file
◉ runtest	`PACKAGES/eff/H2/in.h2`	0.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/eff/H_plasma/in.h2bulk.npt`	63.9	completed, numerical checks skipped due to missing the reference log file the run needs 64 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/eff/H_plasma/in.h2bulk.nve`	95.5	completed, numerical checks skipped due to missing the reference log file the run needs 96 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/eff/H_plasma/in.h2bulk.nve.ang`	97.8	completed, numerical checks skipped due to missing the reference log file the run needs 98 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/eff/Li-dendritic/in.Li-dendritic.min`	44.6	completed, numerical checks skipped due to missing the reference log file
◉ runtest	`PACKAGES/eff/Li-dendritic/in.Li-dendritic.nvt`	87.2	completed, numerical checks skipped due to missing the reference log file the run needs 87 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/eff/Li-solid/in.Li.ang`	28.0	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/eff/Li-solid/in.Li.bohr`	60.2	completed, numerical checks skipped due to missing the reference log file the run needs 60 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/eff/fixed-core/C2H6/in.C2H6fc.ang`	0.5	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/eff/fixed-core/C2H6/in.C2H6fc.bohr`	0.5	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.C2H6fc.ang.smoke.1 in this folder match no input script at all: check the names
◉ runtest	`PACKAGES/eff/fixed-core/CH4/in.CH4fc.ang`	0.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.CH4fc.spe.bohr.1 in this folder match no input script at all: check the names
◉ runtest	`PACKAGES/eff/fixed-core/CH4/in.CH4fc.bohr`	0.5	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.CH4fc.ang.smoke.1, log.CH4fc.spe.ang.1, log.CH4fc.spe.bohr.1 in this folder match no input script at all: check the names
◉ runtest	`PACKAGES/eff/fixed-core/CH4/in.CH4fc.spe.ang`	0.5	completed, numerical checks skipped due to missing the reference log file no reference log file matches this input, while log.CH4fc.ang.smoke.1, log.CH4fc.spe.bohr.1 in this folder match no input script at all: check the names
◉ runtest	`PACKAGES/eff/fixed-core/CH4/in.CH4fc.spe.bohr`	0.7	completed, numerical checks skipped due to missing the reference log file
✓ passed	`PACKAGES/electrode/graph-il/in.graph-il-conp`	71.4	the run needs 71 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/electrode/graph-il/in.graph-il-conq`	64.8	the run needs 65 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/electrode/graph-il/in.graph-il-conq2`	69.8	the run needs 70 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/electrode/graph-il/in.graph-il-etypes`	64.5	the run needs 64 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/electrode/graph-il/in.graph-il-ffield`	68.6	the run needs 69 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/electrode/graph-il/in.graph-il-ramp`	61.8	the run needs 62 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/electrode/graph-il/in.graph-il-thermo`	68.9	the run needs 69 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/electrode/madelung/in.madelung-cg`	0.7
✓ passed	`PACKAGES/electrode/madelung/in.madelung-eta`	0.6
✓ passed	`PACKAGES/electrode/madelung/in.madelung-eta_cg`	0.6
✓ passed	`PACKAGES/electrode/madelung/in.madelung-eta_mix`	0.7
✓ passed	`PACKAGES/electrode/madelung/in.madelung-ewald-ew2d`	0.7
✓ passed	`PACKAGES/electrode/madelung/in.madelung-ewald-ew3dc`	0.7
✓ passed	`PACKAGES/electrode/madelung/in.madelung-ewald-ffield`	0.7
✓ passed	`PACKAGES/electrode/madelung/in.madelung-pppm-ew3dc`	0.8
✓ passed	`PACKAGES/electrode/madelung/in.madelung-pppm-ffield`	0.6
✓ passed	`PACKAGES/electrode/planar/in.planar-ewald-ew2d`	0.7
✓ passed	`PACKAGES/electrode/planar/in.planar-ewald-ew3dc`	0.6
✓ passed	`PACKAGES/electrode/planar/in.planar-ewald-ffield`	0.8
✓ passed	`PACKAGES/electrode/planar/in.planar-pppm-ew3dc`	2.5
✓ passed	`PACKAGES/electrode/planar/in.planar-pppm-ffield`	2.6
✓ passed	`PACKAGES/electron_stopping/in.cascade_AlCu`	9.7
✓ passed	`PACKAGES/electron_stopping/in.cascade_SiSi`	18.5
✓ passed	`PACKAGES/electron_stopping/in.elstop`	33.0
✓ passed	`PACKAGES/electron_stopping/in.elstop.only`	2.1
◉ runtest	`PACKAGES/entropy/in.entropy`	2.3	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
✗ failed	`PACKAGES/extep/in.extep-bn`	1.0	completed, 3 abs diff and 3 rel diff checks failed differs from step 20 on (output row 2)
◉ runtest	`PACKAGES/fep/C7inEthanol/fep01/in.insertion`	0.8	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/C7inEthanol/fep10/in.deletion`	1.1	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CC-CO/fep01/in.fep01.lmp`	1.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CC-CO/fep10/in.fep10.lmp`	2.3	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CH4-CF4/bar01/in.bar01.lmp`	2.1	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CH4-CF4/bar10/in.bar10.lmp`	1.3	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CH4-CF4/fep01/in.fep01.lmp`	1.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CH4-CF4/fep10/in.fep10.lmp`	1.5	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CH4hyd/fdti01/in.fdti01.lmp`	4.5	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CH4hyd/fdti10/in.fdti10.lmp`	4.7	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CH4hyd/fep01/in.fep01.lmp`	3.1	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/CH4hyd/fep10/in.fep10.lmp`	2.7	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/fep/ta/in.spce.lmp`	5.8	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/filter_corotate/in.bpti`	33.5	completed, error parsing log.bpti.1 into YAML
✗ failed	`PACKAGES/filter_corotate/in.peptide`	113.4	completed, 3 abs diff and 3 rel diff checks failed differs from step 100 on (output row 2) the run needs 113 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/flow_gauss/in.GD`	2.1
✓ passed	`PACKAGES/frenkel/in.frenkel`	5.5
◉ runtest	`PACKAGES/gauss_diel/in.gauss-diel`	1.2	completed, error parsing log.gauss-diel.smoke.1 into YAML
◉ runtest	`PACKAGES/gauss_diel/in.gauss-diel-cg`	1.0	completed, error parsing log.gauss-diel-cg.smoke.1 into YAML
◉ runtest	`PACKAGES/gauss_diel/in.gauss-diel-split`	1.0	completed, error parsing log.gauss-diel-split.smoke.1 into YAML
✓ passed	`PACKAGES/gjf/in.gjf.vfull`	15.1
✓ passed	`PACKAGES/gjf/in.gjf.vhalf`	15.3
✗ failed	`PACKAGES/gle/in.h2o-quantum`	16.1	completed, 3 abs diff and 3 rel diff checks failed differs from step 1500 on (output row 15)
✗ failed	`PACKAGES/gle/in.h2o-smart`	16.6	completed, 3 abs diff and 3 rel diff checks failed differs from step 3300 on (output row 33)
○ skipped	`PACKAGES/grem/lj-6rep/in.gREM`	0.0	skipped as specified in the test configuration
✗ failed	`PACKAGES/grem/lj-single/in.gREM-npt`	0.7	completed, 4 abs diff and 4 rel diff checks failed differs from step 10 on (output row 1) (last OK: 2026-07-28T00-47-56Z_73a17bb8cd)
✓ passed	`PACKAGES/grem/lj-single/in.gREM-nvt`	0.6
○ skipped	`PACKAGES/grem/lj-temper/in.gREM-temper`	0.0	skipped, needs a multi-partition run ("temper/grem")
◉ runtest	`PACKAGES/hma/in.hma`	90.2	completed, but no Step nor Loop in the output the run needs 90 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/ilves/in.cg-polymers`	4.3
✓ passed	`PACKAGES/ilves/in.covid`	123.4	the run needs 123 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/ilves/in.dimer`	0.9	completed, error parsing log.dimer.1 into YAML
◉ runtest	`PACKAGES/ilves/in.peptide-allbonds`	6.2	completed, error parsing log.peptide-allbonds.1 into YAML
◉ runtest	`PACKAGES/ilves/in.peptide-fixed`	6.3	completed, error parsing log.peptide-fixed.1 into YAML
◉ runtest	`PACKAGES/ilves/in.peptide-ilves`	6.2	completed, error parsing log.peptide-ilves.1 into YAML
◉ runtest	`PACKAGES/ilves/in.peptide-mix`	5.9	completed, error parsing log.peptide-mix.1 into YAML
◉ runtest	`PACKAGES/ilves/in.peptide-rattle`	6.1	completed, error parsing log.peptide-rattle.1 into YAML
◉ runtest	`PACKAGES/ilves/in.peptide-shake`	6.1	completed, error parsing log.peptide-shake.1 into YAML
✓ passed	`PACKAGES/ilves/in.polymelt`	28.7
◉ runtest	`PACKAGES/ilves/in.rhodo-allbonds`	73.0	completed, error parsing log.rhodo-allbonds.1 into YAML the run needs 73 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/ilves/in.rhodo-ilves`	65.8	completed, error parsing log.rhodo-ilves.1 into YAML the run needs 66 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/ilves/in.rhodo-shake`	63.0	completed, error parsing log.rhodo-shake.1 into YAML the run needs 63 s: a production sized run that should be shortened in the repository
○ skipped	`PACKAGES/imd/in.bucky-plus-cnt`	0.0	skipped as specified in the test configuration
○ skipped	`PACKAGES/imd/in.deca-ala-solv-filter_imd`	0.0	skipped as specified in the test configuration
○ skipped	`PACKAGES/imd/in.deca-ala-solv_imd`	0.0	skipped as specified in the test configuration
○ skipped	`PACKAGES/imd/in.deca-ala-solv_imd_v3`	0.0	skipped as specified in the test configuration
○ skipped	`PACKAGES/imd/in.deca-ala_imd`	0.0	skipped as specified in the test configuration
○ skipped	`PACKAGES/imd/in.melt_imd`	0.0	skipped as specified in the test configuration
✓ passed	`PACKAGES/interlayer/aip_water_2dm/in.gr_water`	24.0
✗ failed	`PACKAGES/interlayer/aip_water_2dm/in.gr_water.opt`	12.7	completed, 0 abs diff and 1 rel diff checks failed differs from step 1000 on (output row 10) (last OK: 2026-08-27T14-10-41Z_d1c9032f71)
✗ failed	`PACKAGES/interlayer/drip/in.CH_drip`	2.8	completed, 2 abs diff and 1 rel diff checks failed differs from step 40 on (output row 4)
✓ passed	`PACKAGES/interlayer/drip/in.C_drip`	2.6
✓ passed	`PACKAGES/interlayer/ilp_graphene_hbn/in.bilayer-graphene`	88.5	the run needs 89 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/interlayer/ilp_graphene_hbn/in.bilayer-hBN`	96.9	the run needs 97 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/interlayer/ilp_graphene_hbn/in.grhBN`	90.6	the run needs 91 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/interlayer/ilp_graphene_hbn/in.ilp_graphene_hbn`	95.8	the run needs 96 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/interlayer/ilp_tmds/in.mos2`	76.1	completed, 1 abs diff and 1 rel diff checks failed differs from step 100 on (output row 1) the run needs 76 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/interlayer/kolmogorov_crespi_full/in.bilayer-graphene`	85.6	failed, mismatched columns in the log files the run needs 86 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/interlayer/kolmogorov_crespi_z/in.atom-diffusion`	0.8
✓ passed	`PACKAGES/interlayer/kolmogorov_crespi_z/in.bilayer-graphene`	2.6
✓ passed	`PACKAGES/interlayer/saip_metal/in.gold_gr`	12.4
✗ failed	`PACKAGES/interlayer/saip_metal_tmd/in.au_mos2`	84.7	completed, 3 abs diff and 2 rel diff checks failed differs from step 100 on (output row 1) the run needs 85 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/latboltz/diffusingsphere/in.trapnewsphere`	13.4	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/latboltz/microrheology/in.microrheology`	49.7	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
✓ passed	`PACKAGES/latboltz/pit_geometry/in.pits`	174.9	the run needs 175 s: a production sized run that should be shortened in the repository
◉ runtest	`PACKAGES/latboltz/planewall/in.planewall`	12.2	completed, but no Step nor Loop in the output
◉ runtest	`PACKAGES/latboltz/polymer/in.polymer`	7.1	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/latboltz/translocation/in.translocation`	6.4	completed, but no Step nor Loop in the output
◉ runtest	`PACKAGES/local_density/benzene_water/in.benzene_water`	31.3	completed, but no Step nor Loop in the output
◉ runtest	`PACKAGES/local_density/methanol_implicit_water/in.methanol_implicit_water`	80.6	completed, but no Step nor Loop in the output the run needs 81 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/machdyn/aluminum_strip_pull/in.aluminum_strip_pull`	2.3
✓ passed	`PACKAGES/machdyn/fluid_structure_interaction/in.fluid_structure_interaction`	30.7
✓ passed	`PACKAGES/machdyn/funnel_flow/in.funnel_flow`	35.3
✗ failed	`PACKAGES/machdyn/rubber_rings_3d/in.rubber_rings_3d`	23.4	completed, 1 abs diff and 1 rel diff checks failed differs from step 100 on (output row 1)
✓ passed	`PACKAGES/machdyn/rubber_strip_pull/in.rubber_strip_pull`	3.4
✗ failed	`PACKAGES/manybody_table/in.spce`	6.3	completed, 3 abs diff and 3 rel diff checks failed differs from step 400 on (output row 4)
✗ failed	`PACKAGES/manybody_table/in.spce2`	5.9	completed, 3 abs diff and 3 rel diff checks failed differs from step 400 on (output row 4)
✗ failed	`PACKAGES/manybody_table/in.spce_sw`	6.3	completed, 1 abs diff and 1 rel diff checks failed differs from step 900 on (output row 9)
◉ runtest	`PACKAGES/mbx/256h2o/in.mbx_h2o`	78.5	completed, numerical checks skipped due to missing the reference log file the run needs 79 s: a production sized run that should be shortened in the repository; no reference log file matches this input, while log.21Jul26.256h2o.g++.1 in this folder match no input script at ...
◉ runtest	`PACKAGES/mbx/256h2o_dipole/in.mbx_h2o`	84.2	completed, numerical checks skipped due to missing the reference log file the run needs 84 s: a production sized run that should be shortened in the repository; no reference log file matches this input, while log.21Jul26.256h2o_dipole.g++.1 in this folder match no input scr ...
◉ runtest	`PACKAGES/mbx/mof_ff_lammps+1_h2o_mbx/in.mbx_mof_1h2o`	34.3	completed, numerical checks skipped due to missing the reference log file no reference log file matches this input, while log.21Jul26.mof.g++.1 in this folder match no input script at all: check the names
◉ runtest	`PACKAGES/mbx/na+_slab/in.slab`	192.7	completed, numerical checks skipped due to missing the reference log file the run needs 193 s: a production sized run that should be shortened in the repository; no reference log file matches this input, while log.21Jul26.na+_slab.g++.1 in this folder match no input script ...
✓ passed	`PACKAGES/meam_spline/in.meam-spline.Si`	2.6
✓ passed	`PACKAGES/meam_spline/in.meam-spline.TiO2`	101.4	the run needs 101 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/meam_sw_spline/Si/in.bcc`	0.6
✓ passed	`PACKAGES/meam_sw_spline/Si/in.bcc_relax`	0.7
✓ passed	`PACKAGES/meam_sw_spline/Si/in.dc`	0.6
✓ passed	`PACKAGES/meam_sw_spline/Si/in.dc_relax`	1.9
✓ passed	`PACKAGES/meam_sw_spline/Si/in.energy_conservation.meam.sw`	19.6
✓ passed	`PACKAGES/meam_sw_spline/Si/in.fcc`	0.5
✓ passed	`PACKAGES/meam_sw_spline/Si/in.fcc_relax`	0.7
✓ passed	`PACKAGES/meam_sw_spline/Si/in.hcp_relax`	1.9
✓ passed	`PACKAGES/meam_sw_spline/Si/in.sc`	0.7
✓ passed	`PACKAGES/meam_sw_spline/Si/in.sc_relax`	0.8
✓ passed	`PACKAGES/meam_sw_spline/Si/in.single_atom`	0.5
✓ passed	`PACKAGES/meam_sw_spline/Ti/in.alpha`	0.5
✓ passed	`PACKAGES/meam_sw_spline/Ti/in.alpha_relaxation`	2.0
✓ passed	`PACKAGES/meam_sw_spline/Ti/in.beta`	0.5
✗ failed	`PACKAGES/meam_sw_spline/Ti/in.energy_conservation.meam.sw`	93.9	completed, 2 abs diff and 2 rel diff checks failed differs from step 140 on (output row 14) the run needs 94 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/meam_sw_spline/Ti/in.fcc`	0.6
✓ passed	`PACKAGES/meam_sw_spline/Ti/in.hexagonal`	0.5
✓ passed	`PACKAGES/meam_sw_spline/Ti/in.omega`	0.5
✓ passed	`PACKAGES/meam_sw_spline/Ti/in.single_atom`	0.5
✓ passed	`PACKAGES/mesont/in.film_mesocnt`	13.9
✓ passed	`PACKAGES/mgpt/in.bcc0`	0.8
✓ passed	`PACKAGES/mgpt/in.vac0-bcc`	0.6
✓ passed	`PACKAGES/mgpt/in.vacmin-bcc`	9.7
✓ passed	`PACKAGES/ml-runner/in.ml-runner.H2O`	4.2
✓ passed	`PACKAGES/mofff/in.hkust1`	0.8
✓ passed	`PACKAGES/mofff/in.hkust1_long`	0.7
✓ passed	`PACKAGES/momb/in.system`	18.9
✗ failed	`PACKAGES/moments/in.converge`	30.5	failed, thermo checks skipped due to mismatched number of steps in the log files
✓ passed	`PACKAGES/moments/in.simple`	32.7
✓ passed	`PACKAGES/moments/in.valtest`	1.1
◉ runtest	`PACKAGES/momentum/in.momentum`	0.7	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
✓ passed	`PACKAGES/mop/in.compute_stress_mop`	0.5
✓ passed	`PACKAGES/neighbor-swap/in.KMC_pulse_center`	72.6	the run needs 73 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/neighbor-swap/in.KMC_pulse_edge`	73.2	the run needs 73 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/orient_eco/in.orient_eco`	139.9	the run needs 140 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/pace/compute/in.compute`	0.8
✓ passed	`PACKAGES/pace/in.pace.product`	15.0
✓ passed	`PACKAGES/pace/in.pace.recursive`	7.9
✓ passed	`PACKAGES/pafi/in.pafi`	7.2
✗ failed	`PACKAGES/pedone/in.pedone.melt`	16.7	completed, 2 abs diff and 2 rel diff checks failed differs from step 600 on (output row 6)
✗ failed	`PACKAGES/pedone/in.pedone.relax`	25.5	failed, thermo checks skipped due to mismatched number of steps in the log files
◉ runtest	`PACKAGES/phonon/1-1D-mono/in.Ana`	0.7	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
○ skipped	`PACKAGES/phonon/1-1D-mono/in.disp`	0.0	skipped as specified in the test configuration
✓ passed	`PACKAGES/phonon/2-1D-diatomic/in.Ana`	21.8
○ skipped	`PACKAGES/phonon/2-1D-diatomic/in.disp`	0.0	skipped as specified in the test configuration
◉ runtest	`PACKAGES/phonon/3-3D-FCC-Cu-EAM/in.EAM3D`	0.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
○ skipped	`PACKAGES/phonon/3-3D-FCC-Cu-EAM/in.disp`	0.0	skipped as specified in the test configuration
○ skipped	`PACKAGES/phonon/3-3D-FCC-Cu-EAM/in.disp2`	0.0	skipped as specified in the test configuration
○ skipped	`PACKAGES/phonon/3-3D-FCC-Cu-EAM/in.dos`	0.0	skipped as specified in the test configuration
○ skipped	`PACKAGES/phonon/4-Graphene/in.disp`	0.0	skipped as specified in the test configuration
◉ runtest	`PACKAGES/phonon/4-Graphene/in.graphene`	0.7	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/phonon/dynamical_matrix_command/Silicon/in.silicon`	0.6	completed, but no Step nor Loop in the output
○ skipped	`PACKAGES/pimd/langevin_metal_units/in.langevin.metal`	0.0	skipped, needs a multi-partition run ("variable ibead uloop")
○ skipped	`PACKAGES/pimd/langevin_metal_units/in.pimd-langevin.metal`	0.0	skipped, needs a multi-partition run ("variable ibead uloop")
○ skipped	`PACKAGES/pimd/langevin_reduced_units/in.lmp`	0.0	skipped, needs a multi-partition run ("variable ibead uloop")
○ skipped	`PACKAGES/pimd/langevin_reduced_units_group/in.lmp`	0.0	skipped, needs a multi-partition run ("variable ibead uloop")
○ skipped	`PACKAGES/pimd/para-h2/in.scp`	0.0	skipped, needs a multi-partition run ("variable ibead uloop")
○ skipped	`PACKAGES/pimd/prot-hairpin/in.scp`	0.0	skipped, needs a multi-partition run ("variable ibead uloop")
○ skipped	`PACKAGES/pimd_bosonic/harmonic_trap_langevin/in.lmp`	0.0	skipped, needs a multi-partition run ("variable ibead uloop")
○ skipped	`PACKAGES/pimd_bosonic/harmonic_trap_nvt/in.lmp`	0.0	skipped, needs a multi-partition run ("variable ibead uloop")
○ skipped	`PACKAGES/pod/InP/in.fitpod.InP`	0.0	skipped as specified in the test configuration
○ skipped	`PACKAGES/pod/InP/in.pod.InP`	0.0	skipped as specified in the test configuration
◉ runtest	`PACKAGES/pod/Ta/in.fitpod`	1.0	completed, but no Step nor Loop in the output
✓ passed	`PACKAGES/pod/Ta/in.pod`	0.8
✓ passed	`PACKAGES/pod/Ta/in.pod.compute`	0.5
✓ passed	`PACKAGES/ptm/in.ptm`	0.7
✗ failed	`PACKAGES/qtb/alpha_quartz_qbmsst/in.alpha_quartz_qbmsst`	64.9	completed, 3 abs diff and 4 rel diff checks failed differs in the very first thermo output the run needs 65 s: a production sized run that should be shortened in the repository
✗ failed	`PACKAGES/qtb/alpha_quartz_qtb/in.alpha_quartz_qtb`	14.7	completed, 2 abs diff and 2 rel diff checks failed differs from step 1000 on (output row 2)
✓ passed	`PACKAGES/qtb/methane_qbmsst/in.methane_qbmsst`	107.8	the run needs 108 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/qtb/methane_qtb/in.methane_qtb`	12.3
✓ passed	`PACKAGES/quip/in.gap`	2.2
✓ passed	`PACKAGES/quip/in.molecular`	0.8
✓ passed	`PACKAGES/quip/in.sw`	1.7
✗ failed	`PACKAGES/reaction/create_atoms_polystyrene/in.grow_styrene`	9.5	completed, 2 abs diff and 2 rel diff checks failed differs from step 500 on (output row 5)
✓ passed	`PACKAGES/reaction/nylon,6-6_melt/in.large_nylon_melt`	83.3	the run needs 83 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/reaction/tiny_epoxy/in.tiny_epoxy.stabilized`	1.4
✗ failed	`PACKAGES/reaction/tiny_nylon/in.tiny_nylon.stabilized`	3.8	completed, 2 abs diff and 2 rel diff checks failed differs from step 550 on (output row 11)
✓ passed	`PACKAGES/reaction/tiny_nylon/in.tiny_nylon.stabilized_variable_probability`	0.8
✓ passed	`PACKAGES/reaction/tiny_nylon/in.tiny_nylon.unstabilized`	0.7
✗ failed	`PACKAGES/reaction/tiny_nylon_json/in.tiny_nylon.stabilized`	2.4	completed, 2 abs diff and 2 rel diff checks failed differs from step 550 on (output row 11)
✗ failed	`PACKAGES/reaction/tiny_nylon_wildcards/in.tiny_nylon.stabilized`	2.2	completed, 2 abs diff and 2 rel diff checks failed differs from step 550 on (output row 11) (last OK: 2026-08-22T09-25-52Z_320a38e835)
✗ failed	`PACKAGES/reaction/tiny_polystyrene/in.tiny_polystyrene.stabilized`	26.3	completed, 2 abs diff and 2 rel diff checks failed differs from step 10000 on (output row 1), but the thermo output is too sparse to tell when it started
✓ passed	`PACKAGES/relres/in.22DMH.real`	69.5	the run needs 69 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/relres/in.22DMH.relres`	11.6
✓ passed	`PACKAGES/relres/in.22DMH.respa`	8.4
✓ passed	`PACKAGES/rhok/in.crystal`	28.2
✓ passed	`PACKAGES/rhok/in.pinning`	27.1
✓ passed	`PACKAGES/rhok/in.setup`	22.4
✓ passed	`PACKAGES/shock/hugoniostat/in.hugoniostat`	12.5
✓ passed	`PACKAGES/shock/msst/in.msst`	8.9
✗ failed	`PACKAGES/shock/nemd/in.nemd`	23.9	completed, 8 abs diff and 8 rel diff checks failed differs from step 800 on (output row 12)
◉ runtest	`PACKAGES/slater/in.slater`	36.0	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/sna_nnn_slcsa/in.slcsa`	60.8	completed, error parsing log.slcsa.1 into YAML the run needs 61 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/srp/in.srp`	9.8
✓ passed	`PACKAGES/srp_react/in.srp_react`	83.4	the run needs 83 s: a production sized run that should be shortened in the repository
✓ passed	`PACKAGES/stressprofile/in.cylinder`	6.8
✓ passed	`PACKAGES/stressprofile/in.flat`	4.1
✓ passed	`PACKAGES/stressprofile/in.sphere`	2.7
✓ passed	`PACKAGES/tally/in.force`	3.2
✓ passed	`PACKAGES/tally/in.pe`	4.3
✓ passed	`PACKAGES/tally/in.stress`	2.2
○ skipped	`PACKAGES/temper_npt/in.temper_npt`	0.0	skipped, needs a multi-partition run ("temper/npt")
◉ runtest	`PACKAGES/ti/in.ti_spring`	0.9	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/tmd/in.tmd`	6.4	completed, error parsing log.tmd.1 into YAML
✓ passed	`PACKAGES/tracker/in.track`	1.1
✓ passed	`PACKAGES/uef/npt_biaxial/in.npt_biaxial`	5.3
✓ passed	`PACKAGES/uef/nvt_uniaxial/in.nvt_uniaxial`	5.2
✓ passed	`PACKAGES/uf3/in.uf3.Nb`	0.7
◉ runtest	`PACKAGES/vtk/in.vtk`	1.0	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/vtk/in.vtp`	1.0	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`PACKAGES/yaff/mil53al/in.mil53a`	15.6	completed, error parsing log.mil53a.1 into YAML
◉ runtest	`PACKAGES/yaff/mof5/in.mof5`	3.9	completed, error parsing log.mof5.1 into YAML
✓ passed	`SPIN/bfo/in.spin.bfo`	7.8
✓ passed	`SPIN/cobalt_fcc/in.spin.cobalt_fcc`	2.9
✓ passed	`SPIN/cobalt_hcp/in.spin.cobalt_hcp`	3.4
✓ passed	`SPIN/dipole_spin/in.spin.iron_dipole_cut`	6.1
✓ passed	`SPIN/dipole_spin/in.spin.iron_dipole_ewald`	13.9
✓ passed	`SPIN/dipole_spin/in.spin.iron_dipole_pppm`	13.2
○ skipped	`SPIN/gneb/iron/in.gneb.iron`	0.0	skipped, needs a multi-partition run ("fix 3 all neb/spin")
○ skipped	`SPIN/gneb/skyrmion/in.gneb.skyrmion`	0.0	skipped, needs a multi-partition run ("fix 3 all neb/spin")
✓ passed	`SPIN/iron/in.spin.iron`	1.7
✓ passed	`SPIN/iron/in.spin.iron_cubic`	2.1
✓ passed	`SPIN/nickel/in.spin.nickel`	2.7
✓ passed	`SPIN/nickel/in.spin.nickel_cubic`	3.1
✓ passed	`SPIN/read_restart/in.spin.read_data`	5.9
✓ passed	`SPIN/read_restart/in.spin.restart`	1.7
✓ passed	`SPIN/read_restart/in.spin.write_restart`	2.1
✓ passed	`SPIN/setforce_spin/in.spin.setforce`	0.7
✓ passed	`SPIN/spinmin/in.spin.bfo_min`	7.4
✓ passed	`SPIN/spinmin/in.spin.bfo_min_cg`	8.9
✓ passed	`SPIN/spinmin/in.spin.bfo_min_lbfgs`	0.9
✓ passed	`SPIN/spinmin/in.spin.iron_min`	0.9
✗ failed	`SPIN/test_problems/validation_nve/in.spin.iron-nve`	3.3	completed, 2 abs diff and 2 rel diff checks failed differs from step 6400 on (output row 32)
✗ failed	`SPIN/test_problems/validation_nvt/in.spin.nvt_lattice`	13.6	completed, 3 abs diff and 3 rel diff checks failed differs from step 200 on (output row 1)
✓ passed	`SPIN/test_problems/validation_nvt/in.spin.nvt_spin`	13.1
✓ passed	`UNITS/in.ar.lj`	0.5
✓ passed	`UNITS/in.ar.metal`	0.7
✓ passed	`UNITS/in.ar.real`	0.7
✓ passed	`airebo/in.airebo`	80.7	the run needs 81 s: a production sized run that should be shortened in the repository
✓ passed	`airebo/in.airebo-0-0`	7.3
✓ passed	`airebo/in.airebo-bc`	84.7	the run needs 85 s: a production sized run that should be shortened in the repository
✓ passed	`airebo/in.airebo-m`	92.3	the run needs 92 s: a production sized run that should be shortened in the repository
✓ passed	`airebo/in.rebo2`	7.4
✓ passed	`amoeba/in.ubiquitin`	17.3
✓ passed	`amoeba/in.water_box.amoeba`	11.2
✓ passed	`amoeba/in.water_box.hippo`	11.0
✓ passed	`amoeba/in.water_dimer.amoeba`	0.6
✓ passed	`amoeba/in.water_dimer.hippo`	0.7
✓ passed	`amoeba/in.water_hexamer.amoeba`	0.6
✓ passed	`amoeba/in.water_hexamer.hippo`	0.6
✓ passed	`atm/in.atm`	15.6
◉ runtest	`balance/in.balance`	0.7	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
◉ runtest	`balance/in.balance.bond.fast`	0.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.bond.slow.smoke.1, log.balance.clock.static.smoke.1, log.balance.group.static.smoke.1, ... in this folder match no input script at all: chec ...
◉ runtest	`balance/in.balance.bond.slow`	0.7	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
◉ runtest	`balance/in.balance.clock.dynamic`	3.2	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.bond.fast.smoke.1, log.balance.bond.slow.smoke.1, log.balance.clock.static.smoke.1, ... in this folder match no input script at all: check t ...
◉ runtest	`balance/in.balance.clock.static`	4.1	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.neigh.dynamic.smoke.1, log.balance.neigh.static.smoke.1 in this folder match no input script at all: check the names
◉ runtest	`balance/in.balance.group.dynamic`	1.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.bond.slow.smoke.1, log.balance.clock.static.smoke.1, log.balance.group.static.smoke.1, ... in this folder match no input script at all: chec ...
◉ runtest	`balance/in.balance.group.static`	1.7	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
◉ runtest	`balance/in.balance.kspace`	2.4	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.neigh.dynamic.smoke.1, log.balance.neigh.static.smoke.1 in this folder match no input script at all: check ...
◉ runtest	`balance/in.balance.neigh.dynamic`	5.1	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.neigh.static.smoke.1 in this folder match no input script at all: check the names
◉ runtest	`balance/in.balance.neigh.rcb`	2.5	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
◉ runtest	`balance/in.balance.neigh.static`	6.4	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`balance/in.balance.var.dynamic`	5.1	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.balance.clock.static.smoke.1, log.balance.kspace.smoke.1, log.balance.neigh.dynamic.smoke.1, ... in this folder match no input script at all: check ...
✓ passed	`body/in.body`	1.6
✗ failed	`body/in.cubes`	37.9	completed, 2 abs diff and 2 rel diff checks failed differs from step 1000 on (output row 1)
✓ passed	`body/in.pour3d`	1.2
✗ failed	`body/in.squares`	4.6	completed, 3 abs diff and 3 rel diff checks failed differs from step 1000 on (output row 1)
✗ failed	`body/in.wall2d`	4.1	completed, 3 abs diff and 3 rel diff checks failed differs from step 1000 on (output row 1)
✓ passed	`bpm/impact/in.bpm.impact.rotational`	81.4	the run needs 81 s: a production sized run that should be shortened in the repository
✓ passed	`bpm/impact/in.bpm.impact.spring`	11.6
✓ passed	`bpm/metamaterial/in.bpm.metamaterial`	111.3	the run needs 111 s: a production sized run that should be shortened in the repository
✓ passed	`bpm/peri/benchmark/in.bench.bpm.pmb`	3.3
✓ passed	`bpm/peri/benchmark/in.bench.legacy.pmb`	8.6
✓ passed	`bpm/peri/in.bpm.peri.eps`	38.6
✓ passed	`bpm/peri/in.bpm.peri.lps`	32.2
✓ passed	`bpm/peri/in.bpm.peri.pmb`	27.5
✓ passed	`bpm/peri/in.bpm.peri.ves`	35.7
✓ passed	`bpm/plasticity/in.bpm.plasticity`	164.1	the run needs 164 s: a production sized run that should be shortened in the repository
✓ passed	`bpm/poissons_ratio/in.bpm.poissons_ratio`	90.0	the run needs 90 s: a production sized run that should be shortened in the repository
◉ runtest	`bpm/pour/in.bpm.pour`	0.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
✓ passed	`bpm/wires/in.bpm.wires`	21.5
✗ failed	`charmmfsw/in.charmmfsw`	21.3	completed, 2 abs diff and 1 rel diff checks failed differs from step 20 on (output row 2)
✗ failed	`cmap/in.cmap`	1.9	completed, 1 abs diff and 1 rel diff checks failed differs from step 10000 on (output row 10)
✗ failed	`colloid/in.colloid`	6.2	completed, 3 abs diff and 3 rel diff checks failed differs from step 6000 on (output row 6)
✓ passed	`comb/in.comb.Cu`	0.7
✓ passed	`comb/in.comb.Cu2O.elastic`	25.4
✓ passed	`comb/in.comb.HfO2`	5.9
✓ passed	`comb/in.comb.Si`	0.7
✓ passed	`comb/in.comb.Si.elastic`	1.2
✓ passed	`comb/in.comb3`	15.3
✓ passed	`controller/in.controller.temp`	12.1
✓ passed	`controller/in.controller.wall`	31.0
✗ failed	`coreshell/in.coreshell`	15.9	completed, 7 abs diff and 8 rel diff checks failed differs from step 100 on (output row 2)
✓ passed	`coreshell/in.coreshell.dsf`	25.9
✗ failed	`coreshell/in.coreshell.thermostats`	20.3	completed, 12 abs diff and 13 rel diff checks failed differs from step 100 on (output row 2)
✗ failed	`coreshell/in.coreshell.wolf`	35.4	completed, 10 abs diff and 10 rel diff checks failed differs from step 50 on (output row 1)
✓ passed	`crack/in.crack`	6.1
✓ passed	`deposit/in.deposit.atom`	4.2
✓ passed	`deposit/in.deposit.molecule`	5.7
✓ passed	`deposit/in.deposit.molecule.rigid-nve-small`	5.8
✓ passed	`deposit/in.deposit.molecule.rigid-nvt-small`	3.9
✓ passed	`deposit/in.deposit.molecule.rigid-small`	5.9
✓ passed	`deposit/in.deposit.molecule.shake`	5.6
✓ passed	`dipole/in.charge_dipole`	25.9
✓ passed	`dipole/in.dipole`	1.3
◉ runtest	`dreiding/in.dreiding`	0.7	completed, error parsing log.dreiding.1 into YAML
✗ failed	`eim/in.eim`	4.7	completed, 2 abs diff and 2 rel diff checks failed differs from step 50 on (output row 1)
✗ failed	`ellipse/in.ellipse.gayberne`	2.0	completed, 2 abs diff and 2 rel diff checks failed differs from step 2400 on (output row 25)
✗ failed	`ellipse/in.ellipse.resquared`	4.3	completed, 0 abs diff and 2 rel diff checks failed differs from step 2900 on (output row 30)
✓ passed	`fire/in.abcfire`	1.0
✓ passed	`fire/in.abcfire_mod`	1.6
✓ passed	`fire/in.cg`	0.9
✓ passed	`fire/in.fire`	1.1
✓ passed	`fire/in.fire_mod`	0.8
✓ passed	`fire/in.meam.abcfire`	64.1	the run needs 64 s: a production sized run that should be shortened in the repository
✓ passed	`fire/in.meam.fire`	88.8	the run needs 89 s: a production sized run that should be shortened in the repository
○ skipped	`fire/in.neb.sivac.abcfire`	0.0	skipped, needs a multi-partition run ("variable u uloop")
○ skipped	`fire/in.neb.sivac.abcfire_mod`	0.0	skipped, needs a multi-partition run ("variable u uloop")
○ skipped	`fire/in.neb.sivac.fire`	0.0	skipped, needs a multi-partition run ("variable u uloop")
○ skipped	`fire/in.neb.sivac.fire_mod`	0.0	skipped, needs a multi-partition run ("variable u uloop")
○ skipped	`fire/in.neb.sivac.qm`	0.0	skipped, needs a multi-partition run ("variable u uloop")
✓ passed	`flow/in.flow.couette`	0.8
✓ passed	`flow/in.flow.pois`	0.7
✓ passed	`friction/in.friction`	4.7
✗ failed	`granregion/in.granregion.box`	0.9	completed, 6 abs diff and 10 rel diff checks failed differs from step 400 on (output row 4)
✓ passed	`granregion/in.granregion.funnel`	127.4	the run needs 127 s: a production sized run that should be shortened in the repository
✓ passed	`granregion/in.granregion.mixer`	39.0
✓ passed	`gransurf/in.line.gran.data`	0.7
✓ passed	`gransurf/in.line.gran.global`	0.6
✓ passed	`gransurf/in.line.gran.surf`	1.0
✓ passed	`gransurf/in.screwfeeder.local`	107.2	the run needs 107 s: a production sized run that should be shortened in the repository
✓ passed	`gransurf/in.tri.gran.data`	0.8
✓ passed	`gransurf/in.tri.gran.global`	1.1
✓ passed	`gransurf/in.tri.gran.global.stl`	1.4
✓ passed	`gransurf/in.tri.gran.surf`	0.9
✓ passed	`gransurf/in.tri.gran.surf.stl`	1.4
✓ passed	`gransurf/in.tribox.gran.data`	3.3
✓ passed	`gransurf/in.tribox.gran.global`	2.9
✓ passed	`gransurf/in.tribox.gran.global.stl`	1.1
✓ passed	`gransurf/in.tribox.gran.surf`	3.2
✓ passed	`gransurf/in.tribox.gran.surf.stl`	2.6
✓ passed	`granular/in.pour.drum`	15.7
✓ passed	`granular/in.pour.flatwall`	9.2
✓ passed	`granular/in.pour.heat`	106.1	the run needs 106 s: a production sized run that should be shortened in the repository
✓ passed	`granular/in.restitution`	1.7
✓ passed	`granular/in.sync_verlet`	0.9
✓ passed	`granular/in.tableting.200`	20.5
✓ passed	`granular/in.triaxial.compaction.12`	2.0
✓ passed	`grid/in.grid.2d`	0.6
✓ passed	`grid/in.grid.3d`	2.0
✓ passed	`grid/in.sph`	46.3
◉ runtest	`hyper/in.hyper.global`	72.8	completed, no reference log file, only checked that a run shortened to 100 steps does not crash the run needs 73 s: a production sized run that should be shortened in the repository (it does not even finish with its run commands shortened to 100 steps, so the cost is in the setup)
◉ runtest	`hyper/in.hyper.local`	18.9	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.hyper.global.smoke.1 in this folder match no input script at all: check the names
✓ passed	`indent/in.indent`	2.8
✓ passed	`indent/in.indent.min`	0.7
✓ passed	`kim/in.lammps.melt`	2.8
✓ passed	`mc/in.gcmc.co2`	18.6
✗ failed	`mc/in.gcmc.h2o`	144.6	completed, 3 abs diff and 3 rel diff checks failed differs from step 1000 on (output row 3) the run needs 145 s: a production sized run that should be shortened in the repository
✓ passed	`mc/in.gcmc.lj`	20.7
✓ passed	`mc/in.gcmc.restart`	15.8
○ skipped	`mc/in.gemc.lj`	0.0	skipped, needs a multi-partition run ("partition")
✓ passed	`mc/in.hmc.flexible.melt`	19.7
✗ failed	`mc/in.hmc.rigid`	18.8	completed, 6 abs diff and 6 rel diff checks failed differs from step 100 on (output row 1)
◉ runtest	`mc/in.mixed`	0.8	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.24Nov25.gemc.lj.0.g++.5, log.24Nov25.gemc.lj.1.g++.5, log.hmc.flexible.melt.1 in this folder match no input script at all: check the names
◉ runtest	`mc/in.pure`	0.8	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.24Nov25.gemc.lj.0.g++.5, log.24Nov25.gemc.lj.1.g++.5, log.hmc.flexible.melt.1 in this folder match no input script at all: check the names
✓ passed	`mc/in.sgcmc.eam`	65.9	the run needs 66 s: a production sized run that should be shortened in the repository
✓ passed	`mc/in.widom.lj`	15.0
✓ passed	`mc/in.widom.spce`	62.0	the run needs 62 s: a production sized run that should be shortened in the repository
✓ passed	`meam/in.meam`	0.6
✗ failed	`meam/in.meam.shear`	43.1	completed, 3 abs diff and 3 rel diff checks failed differs from step 1600 on (output row 21)
✓ passed	`meam/msmeam/in.msmeam`	0.5
✓ passed	`melt/in.melt`	1.3
✗ failed	`mesh/in.marble_race`	127.1	completed, 5 abs diff and 5 rel diff checks failed differs in the very first thermo output the run needs 127 s: a production sized run that should be shortened in the repository
✗ failed	`mesh/in.mesh_box`	13.8	completed, 3 abs diff and 3 rel diff checks failed differs from step 1400 on (output row 8)
✗ failed	`micelle/in.micelle`	0.8	completed, 0 abs diff and 1 rel diff checks failed differs from step 850 on (output row 38)
✗ failed	`micelle/in.micelle-rigid`	1.0	completed, 6 abs diff and 6 rel diff checks failed differs from step 50 on (output row 12)
✓ passed	`min/in.min`	0.7
✓ passed	`min/in.min.box`	3.4
◉ runtest	`mliap/in.mliap.ace.compute`	1.1	completed, but no Step nor Loop in the output
✓ passed	`mliap/in.mliap.nn.Cu`	7.8
✓ passed	`mliap/in.mliap.nn.Ta06A`	2.7
○ skipped	`mliap/in.mliap.pytorch.Ta06A`	0.0	skipped as specified in the test configuration
○ skipped	`mliap/in.mliap.pytorch.ace`	0.0	skipped as specified in the test configuration
○ skipped	`mliap/in.mliap.pytorch.ace.NN`	0.0	skipped as specified in the test configuration
○ skipped	`mliap/in.mliap.pytorch.relu1hidden`	0.0	skipped as specified in the test configuration
◉ runtest	`mliap/in.mliap.quadratic.compute`	0.7	completed, but no Step nor Loop in the output
✓ passed	`mliap/in.mliap.snap.Ta06A`	1.4
✓ passed	`mliap/in.mliap.snap.WBe.PRB2019`	4.8
✓ passed	`mliap/in.mliap.snap.chem`	26.7
◉ runtest	`mliap/in.mliap.snap.compute`	0.5	completed, but no Step nor Loop in the output
✓ passed	`mliap/in.mliap.snap.quadratic`	3.5
◉ runtest	`mliap/in.mliap.so3.Ni_Mo`	0.7	completed, but no Step nor Loop in the output
✓ passed	`mliap/in.mliap.so3.nn.Si`	6.2
○ skipped	`mliap/in.mliap.unified.lj.Ar`	0.0	skipped as specified in the test configuration
✗ failed	`multi/in.colloid`	1.3	failed, thermo checks skipped due to mismatched number of steps in the log files
✗ failed	`multi/in.granular`	2.2	failed, thermo checks skipped due to mismatched number of steps in the log files
✗ failed	`multi/in.powerlaw`	3.5	failed, thermo checks skipped due to mismatched number of steps in the log files
✓ passed	`nb3b/in.nb3b`	7.8
✓ passed	`nb3b/in.nb3b.screened`	58.1
○ skipped	`neb/in.neb.hop1`	0.0	skipped, needs a multi-partition run ("variable u uloop")
○ skipped	`neb/in.neb.hop1.end`	0.0	skipped, needs a multi-partition run ("variable u uloop")
○ skipped	`neb/in.neb.hop2`	0.0	skipped, needs a multi-partition run ("variable u uloop")
○ skipped	`neb/in.neb.sivac`	0.0	skipped, needs a multi-partition run ("variable u uloop")
✓ passed	`nemd/in.nemd`	0.7
✓ passed	`numdiff/in.numdiff`	1.2
✓ passed	`obstacle/in.obstacle`	2.4
◉ runtest	`peptide/in.peptide`	5.6	completed, error parsing log.peptide.1 into YAML
✓ passed	`peri/in.peri-pmb`	20.6
✓ passed	`peri/in.peri.eps`	40.5
✓ passed	`peri/in.peri.lps`	33.0
✓ passed	`peri/in.peri.pmb`	18.9
✓ passed	`peri/in.peri.ves`	35.8
✓ passed	`pour/in.pour`	23.8
✓ passed	`pour/in.pour.2d`	3.0
✓ passed	`pour/in.pour.2d.molecule`	3.7
○ skipped	`prd/in.prd`	0.0	skipped, needs a multi-partition run ("prd")
✓ passed	`python/in.fix_python_invoke`	0.9
◉ runtest	`python/in.fix_python_invoke_neighlist`	1.1	completed, numerical checks skipped due to missing the reference log file
✓ passed	`python/in.fix_python_move_nve_melt`	9.7
✓ passed	`python/in.fix_python_move_nve_melt_group`	6.3
✓ passed	`python/in.fix_python_move_nve_melt_opt`	1.2
✗ failed	`python/in.pair_python_coulomb`	5.7	completed, 3 abs diff and 3 rel diff checks failed differs in the very first thermo output (last OK: 2026-09-02T09-38-23Z_09fb1ec808)
✓ passed	`python/in.pair_python_harmonic`	51.1
✗ failed	`python/in.pair_python_hybrid`	17.0	completed, 0 abs diff and 3 rel diff checks failed differs from step 350 on (output row 8)
✓ passed	`python/in.pair_python_long`	6.8
✗ failed	`python/in.pair_python_melt`	35.7	completed, 0 abs diff and 3 rel diff checks failed differs from step 350 on (output row 8)
✓ passed	`python/in.pair_python_spce`	16.6
✓ passed	`python/in.pair_python_table`	1.5
✓ passed	`python/in.python`	0.9
✓ passed	`python/in.python.wrap`	0.5
✓ passed	`qeq/in.qeq.buck`	26.4
✓ passed	`qeq/in.qeq.reaxff`	0.7
✗ failed	`rdf-adf/in.spce`	104.5	completed, 6 abs diff and 5 rel diff checks failed differs in the very first thermo output the run needs 104 s: a production sized run that should be shortened in the repository
✗ failed	`rdf-adf/in.spce.hbond`	90.2	completed, 5 abs diff and 5 rel diff checks failed differs from step 200 on (output row 2) the run needs 90 s: a production sized run that should be shortened in the repository
✓ passed	`reaxff/AB/in.AB`	3.8
✓ passed	`reaxff/AuO/in.AuO`	9.2
✓ passed	`reaxff/CHO/in.CHO`	5.8
✓ passed	`reaxff/FC/in.FC`	22.4
✓ passed	`reaxff/FeOH3/in.FeOH3`	4.2
✓ passed	`reaxff/HNS/in.reaxff.hns`	26.9
✓ passed	`reaxff/RDX/in.RDX`	9.6
✓ passed	`reaxff/VOH/in.VOH`	3.2
✓ passed	`reaxff/ZnOH2/in.ZnOH2`	1.3
✓ passed	`reaxff/ci-reaxFF/in.ci-reax.CH`	14.2
✓ passed	`reaxff/in.reaxff.rdx`	0.8
✓ passed	`reaxff/in.reaxff.rdx-shielded`	0.6
✓ passed	`reaxff/in.reaxff.tatb`	3.0
✓ passed	`reaxff/in.reaxff.tatb-shielded`	3.6
✓ passed	`reaxff/water/in.water.acks2`	16.1
✓ passed	`reaxff/water/in.water.acks2.field`	20.6
✓ passed	`reaxff/water/in.water.qeq`	8.6
✓ passed	`reaxff/water/in.water.qeq.field`	7.6
✓ passed	`reaxff/water/in.water.qeqr`	8.4
✓ passed	`reaxff/water/in.water.qeqr.field`	10.8
✓ passed	`reaxff/water/in.water.qtpie`	10.7
✓ passed	`reaxff/water/in.water.qtpie.field`	11.8
✓ passed	`replicate/in.replicate.bond.x`	0.8
✓ passed	`replicate/in.replicate.bond.x.noloop`	0.9
✓ passed	`replicate/in.replicate.bond.x.y`	1.2
✓ passed	`replicate/in.replicate.bond.xy`	1.0
✓ passed	`replicate/in.replicate.cnt`	12.9
◉ runtest	`rheo/balloon/in.rheo.balloon`	1.9	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
✓ passed	`rheo/dam-break/in.rheo.dam.break`	159.1	the run needs 159 s: a production sized run that should be shortened in the repository
✗ failed	`rheo/ice-cubes/in.rheo.ice.cubes`	200.8	completed, 0 abs diff and 1 rel diff checks failed differs from step 200 on (output row 1) the run needs 201 s: a production sized run that should be shortened in the repository (last OK: 2026-07-28T00-47-56Z_73a17bb8cd)
◉ runtest	`rheo/oxidation/in.rheo.oxidation`	1.3	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
◉ runtest	`rheo/poiseuille/in.rheo.poiseuille`	0.9	completed, no reference log file, only checked that a run shortened to 100 steps does not crash
✓ passed	`rheo/taylor-green/in.rheo.taylor.green`	115.0	the run needs 115 s: a production sized run that should be shortened in the repository
✓ passed	`rigid/in.rigid`	0.8
✓ passed	`rigid/in.rigid.atomfile`	0.6
✓ passed	`rigid/in.rigid.atomvar`	0.7
✓ passed	`rigid/in.rigid.cubes`	1.1
✓ passed	`rigid/in.rigid.cubes.gravity`	0.9
✓ passed	`rigid/in.rigid.cubes.langevin`	1.0
◉ runtest	`rigid/in.rigid.cubes.multirun`	0.6	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.rigid.cubes.gravity.1, log.rigid.cubes.langevin.1, log.rigid.cubes.npt.1, ... in this folder match no input script at all: check the names
✓ passed	`rigid/in.rigid.cubes.nph`	1.1
✓ passed	`rigid/in.rigid.cubes.npt`	1.6
✓ passed	`rigid/in.rigid.cubes.nve`	1.2
✓ passed	`rigid/in.rigid.cubes.nvt`	1.2
✓ passed	`rigid/in.rigid.cubes.partial`	0.9
✓ passed	`rigid/in.rigid.cubes.tri`	1.1
✓ passed	`rigid/in.rigid.dipoles`	0.6
✓ passed	`rigid/in.rigid.early`	0.8
✓ passed	`rigid/in.rigid.ellipsoids`	0.6
✓ passed	`rigid/in.rigid.gravity`	1.1
✓ passed	`rigid/in.rigid.infile`	0.8
✓ passed	`rigid/in.rigid.molecule`	0.8
✗ failed	`rigid/in.rigid.nve`	0.5	completed, 3 abs diff and 3 rel diff checks failed differs from step 50 on (output row 1)
✗ failed	`rigid/in.rigid.nve.early`	0.6	completed, 3 abs diff and 3 rel diff checks failed differs from step 50 on (output row 1)
✓ passed	`rigid/in.rigid.property`	0.6
✓ passed	`rigid/in.rigid.small`	0.6
✓ passed	`rigid/in.rigid.small.infile`	0.7
✓ passed	`rigid/in.rigid.spheres`	0.6
✗ failed	`rigid/in.rigid.tnr`	18.1	completed, 18 abs diff and 22 rel diff checks failed differs from step 5800 on (output row 59)
✓ passed	`shear/in.shear`	5.8
✓ passed	`shear/in.shear.void`	6.1
✓ passed	`snap/in.C_SNAP`	58.4
✓ passed	`snap/in.gaussian.grid`	0.7
✓ passed	`snap/in.snap.InP.JCPA2020`	26.5
✓ passed	`snap/in.snap.Mo_Chen`	2.6
✓ passed	`snap/in.snap.Ta06A`	1.0
✓ passed	`snap/in.snap.W.2940`	5.5
✓ passed	`snap/in.snap.WBe.PRB2019`	4.3
◉ runtest	`snap/in.snap.compute`	0.6	completed, but no Step nor Loop in the output
◉ runtest	`snap/in.snap.compute.quadratic`	0.7	completed, but no Step nor Loop in the output
◉ runtest	`snap/in.snap.grid`	0.6	completed, numerical checks skipped due to missing the reference log file no reference log file matches this input, while log.15Jun22.grid.snap.g++.1, log.15Jun22.grid.snap.g++.4, log.15Jun22.grid.tri.g++.1, ... in this folder match no input script at all: check the names
◉ runtest	`snap/in.snap.grid.triclinic`	0.7	completed, numerical checks skipped due to missing the reference log file no reference log file matches this input, while log.15Jun22.grid.snap.g++.1, log.15Jun22.grid.snap.g++.4, log.15Jun22.grid.tri.g++.1, ... in this folder match no input script at all: check the names
✓ passed	`snap/in.snap.hybrid.WSNAP.HePair`	4.2
◉ runtest	`snap/in.snap.scale.Ni_Zuo_JCPA2020`	9.2	completed, no reference log file, only checked that a run shortened to 100 steps does not crash no reference log file matches this input, while log.15Jun22.grid.snap.g++.1, log.15Jun22.grid.snap.g++.4, log.15Jun22.grid.tri.g++.1, ... in this folder match no input script at all: check the names
✗ failed	`srd/in.srd.mixture`	2.0	completed, 3 abs diff and 3 rel diff checks failed differs from step 800 on (output row 10)
✓ passed	`srd/in.srd.pure`	5.9
✓ passed	`steinhardt/in.bcc`	0.7
✓ passed	`steinhardt/in.fcc`	0.5
✓ passed	`steinhardt/in.icos`	2.8
✓ passed	`streitz/in.ctip`	207.8	the run needs 208 s: a production sized run that should be shortened in the repository
◉ runtest	`streitz/in.gan`	1.3	completed, numerical checks skipped due to missing the reference log file
✗ failed	`streitz/in.streitz.ewald`	86.5	completed, 1 abs diff and 2 rel diff checks failed differs in the very first thermo output the run needs 86 s: a production sized run that should be shortened in the repository
✗ failed	`streitz/in.streitz.wolf`	101.4	failed, mismatched columns in the log files the run needs 101 s: a production sized run that should be shortened in the repository
✓ passed	`stress_vcm/in.stress_vcm`	26.9
○ skipped	`tad/in.tad`	0.0	skipped, needs a multi-partition run ("tad")
✗ failed	`template/in.hybrid`	10.0	completed, 3 abs diff and 3 rel diff checks failed differs from step 400 on (output row 4)
✗ failed	`template/in.mol-data-mix`	23.7	completed, 3 abs diff and 3 rel diff checks failed differs from step 200 on (output row 2)
✓ passed	`template/in.mol-restart-mix`	55.9
✗ failed	`template/in.molecular-mix`	34.1	completed, 5 abs diff and 5 rel diff checks failed differs from step 190 on (output row 2)
✗ failed	`template/in.template-mix`	31.8	completed, 5 abs diff and 5 rel diff checks failed differs from step 190 on (output row 2)
✗ failed	`template/in.tmpl-data-mix`	24.0	completed, 3 abs diff and 3 rel diff checks failed differs from step 200 on (output row 2)
✓ passed	`template/in.tmpl-restart-mix`	53.4
✓ passed	`tersoff/in.hBN_shift`	1.2
✓ passed	`tersoff/in.tersoff`	1.3
✓ passed	`threebody/in.mos2-bulk`	0.7
✓ passed	`threebody/in.mos2.rebomos`	28.5
✓ passed	`threebody/in.mos2.sw.mod`	3.3
✓ passed	`threebody/in.threebody`	1.9
✓ passed	`triclinic/in.bcc.orthog`	0.5
✓ passed	`triclinic/in.bcc.primitive`	0.5
✓ passed	`triclinic/in.data.general`	0.7
✓ passed	`triclinic/in.fcc.orthog`	0.7
✓ passed	`triclinic/in.fcc.primitive`	0.7
✓ passed	`triclinic/in.hex.orthog`	0.7
✓ passed	`triclinic/in.hex.primitive`	0.6
✓ passed	`triclinic/in.sq2.orthog`	0.7
✓ passed	`triclinic/in.sq2.primitive`	0.5
✓ passed	`ttm/in.ttm`	27.3
✓ passed	`ttm/in.ttm.cascade`	36.7
✓ passed	`ttm/in.ttm.grid`	29.3
✓ passed	`ttm/in.ttm.mod`	8.2
✓ passed	`ttm/in.ttm.thermal`	28.8
✓ passed	`vashishta/in.vashishta.inp`	0.6
✓ passed	`vashishta/in.vashishta.sio2`	1.6
✓ passed	`vashishta/in.vashishta.table.inp`	0.7
✓ passed	`vashishta/in.vashishta.table.sio2`	1.3
◉ runtest	`voronoi/in.voronoi`	6.5	completed, but no Step nor Loop in the output
◉ runtest	`voronoi/in.voronoi.2d`	0.7	completed, but no Step nor Loop in the output
◉ runtest	`voronoi/in.voronoi.data`	0.6	completed, but no Step nor Loop in the output
✓ passed	`wall/in.wall.block`	4.3
✓ passed	`wall/in.wall.ccl`	0.8
✓ passed	`wall/in.wall.diffusive`	0.9
✓ passed	`wall/in.wall.flow`	7.7
✓ passed	`wall/in.wall.harmonic.2d`	3.2
✓ passed	`wall/in.wall.harmonic.outside.2d`	3.3
✓ passed	`wall/in.wall.lepton`	0.6
✓ passed	`wall/in.wall.maxwell`	1.1
✓ passed	`wall/in.wall.specular`	1.1
✓ passed	`wall/in.wall.sphere`	4.6
✓ passed	`wall/in.wall.table`	0.5
◉ runtest	`yaml/in.yaml`	3.9	completed, error parsing log.yaml.1 into YAML