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cp2k/tests/SE/regtest
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Ole Schütt 6a330cddb3 Remove tabs and trailing spaces
2021-03-11 20:06:46 +01:00
..
b2h6_pm6.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
brcl.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
c2h4.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
c2h4_rm1.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
ch2o.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
ch2o_pm6.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
ch4-ot.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
ch4-restart.inp converting more regs to the new regtester 2010-12-19 22:29:23 +00:00
ch4.inp clening cell type (removing everything connected with units), removing UNIT keyword 2008-11-25 10:57:52 +00:00
dimer_atprop.inp Atomic properties: improvements and new regtests 2011-08-04 11:05:56 +00:00
geom.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
H2O-MNDO-si-nc.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
H2O-MNDO-si.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
H2O-MNDO.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
H2O-MNDOD.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
h2o.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
h2o_gks.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
h2o_gks_e.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
h2o_gks_p.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
h2o_lsd-ot.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
h2o_lsd.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
h2o_vib.inp Stabilize SE h2o_vib test numerically 2019-09-13 11:44:25 +02:00
h2op.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
h2op_2.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
h2po4.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
hcl.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
hcn.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
hcn_pm6.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
hf.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
ice-ewald-mol.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
ice-ewald-nomol.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
ice-ewald-r_cut.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
nh4.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
NO2-ROKS.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
O-ROKS.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
O2-ROKS.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
sih_x.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
sih_y.inp Remove tabs and trailing spaces 2021-03-11 20:06:46 +01:00
st.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
TEST_FILES Adjust threshold of SE/regtest/st.inp 2020-01-20 17:11:21 +01:00
tio.inp a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 2010-12-28 13:33:01 +00:00
tio_noheader.inp Optionally, omit the row/column headers and only print the contents 2015-09-23 14:22:35 +00:00