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Stabilize Fist/regtest-plumed2/water.inp

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Ole Schütt 2022-04-13 20:20:22 +02:00 • committed by Ole Schütt
parent e97efa57dc
commit b5e7ecb55a
2 changed files with 2 additions and 2 deletions
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2
tests/Fist/regtest-plumed2/TEST_FILES
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@ -5,5 +5,5 @@
# for details see cp2k/tools/do_regtest
#
# dang-chang model
water.inp 11 1.0E-14 -0.000549916245559
water.inp 11 1.0E-14 -0.000258715302443
#EOF

2
tests/Fist/regtest-plumed2/water.inp
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@ -13,7 +13,7 @@
&MD
ENSEMBLE NVT
STEPS 20
STEPS 5
TIMESTEP 2.5
TEMPERATURE 298