cp2k/tests/Fist/regtest-6
Dynamics of Condensed Matter 666f2d7d18
Honor element KIND masses for PDB atoms (#5246)
Co-authored-by: Thomas D. Kuehne <tkuehne@cp2k.org>
2026-05-19 02:10:11 +02:00
..
argon_ext.inp Format all input files 2023-12-18 22:41:19 +01:00
C_tersoff.inp Format all input files 2023-12-18 22:41:19 +01:00
cf_genpot.inp Format all input files 2023-12-18 22:41:19 +01:00
cf_genpot_debug.inp Format all input files 2023-12-18 22:41:19 +01:00
cubane_0.inp Format all input files 2023-12-18 22:41:19 +01:00
cubane_15.inp Format all input files 2023-12-18 22:41:19 +01:00
ethene_colv1_g.inp Format all input files 2023-12-18 22:41:19 +01:00
ethene_colv2_g.inp Format all input files 2023-12-18 22:41:19 +01:00
extern_pot-test-01.inp Format all input files 2023-12-18 22:41:19 +01:00
extern_pot-test-02.inp Format all input files 2023-12-18 22:41:19 +01:00
extern_pot-test-03.inp Format all input files 2023-12-18 22:41:19 +01:00
H2O-32_PME_distr.inp Format all input files 2023-12-18 22:41:19 +01:00
JAC_distr.inp Format all input files 2023-12-18 22:41:19 +01:00
NaCl_fe.inp Format all input files 2023-12-18 22:41:19 +01:00
nh3-meta-1_g.inp Format all input files 2023-12-18 22:41:19 +01:00
Pair_CGO-CGO.table Forcefield: Add table potential type TABPOT 2022-10-07 18:11:36 +02:00
Pair_CGO-RES.table Forcefield: Add table potential type TABPOT 2022-10-07 18:11:36 +02:00
Pair_none.table Forcefield: Add table potential type TABPOT 2022-10-07 18:11:36 +02:00
Pair_RES-RES.table Forcefield: Add table potential type TABPOT 2022-10-07 18:11:36 +02:00
pdb_kind_mass.inp Honor element KIND masses for PDB atoms (#5246) 2026-05-19 02:10:11 +02:00
pdb_kind_mass.pdb Honor element KIND masses for PDB atoms (#5246) 2026-05-19 02:10:11 +02:00
Si_tersoff.inp Format all input files 2023-12-18 22:41:19 +01:00
Si_tersoff_2.inp Format all input files 2023-12-18 22:41:19 +01:00
Si_tersoff_3.inp Format all input files 2023-12-18 22:41:19 +01:00
Si_tersoff_rcut.inp Format all input files 2023-12-18 22:41:19 +01:00
siepmann_sprik_fcc.inp Format all input files 2023-12-18 22:41:19 +01:00
siepmann_sprik_H3O.inp Format all input files 2023-12-18 22:41:19 +01:00
siepmann_sprik_O.inp Format all input files 2023-12-18 22:41:19 +01:00
siepmann_sprik_OH.inp Format all input files 2023-12-18 22:41:19 +01:00
siepmann_sprik_top.inp Format all input files 2023-12-18 22:41:19 +01:00
SiH_tersoff.inp Format all input files 2023-12-18 22:41:19 +01:00
tabpot_cgo-cgo.inp Format all input files 2023-12-18 22:41:19 +01:00
tabpot_cgo-res.inp Format all input files 2023-12-18 22:41:19 +01:00
tabpot_res-res.inp Format all input files 2023-12-18 22:41:19 +01:00
tabpot_total.inp Format all input files 2023-12-18 22:41:19 +01:00
TEST_FILES.toml Honor element KIND masses for PDB atoms (#5246) 2026-05-19 02:10:11 +02:00
uo2_buckmorse_nve.inp Format all input files 2023-12-18 22:41:19 +01:00
water_3_ddist.inp Format all input files 2023-12-18 22:41:19 +01:00
water_3_ddist_g.inp Format all input files 2023-12-18 22:41:19 +01:00
water_3_dist_centers.inp Format all input files 2023-12-18 22:41:19 +01:00
water_3_dist_centers2.inp Format all input files 2023-12-18 22:41:19 +01:00
water_3_dist_centers3.inp Format all input files 2023-12-18 22:41:19 +01:00
water_3_dist_g.inp Format all input files 2023-12-18 22:41:19 +01:00
water_3_dist_xyz.inp Format all input files 2023-12-18 22:41:19 +01:00