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10 lines
707 B
TOML
10 lines
707 B
TOML
# runs are executed in the same order as in this file
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# the second field tells which test should be run in order to compare with the last available output
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# e.g. 0 means do not compare anything, running is enough
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# 1 compares the last total energy in the file
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# for details see cp2k/tools/do_regtest
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"ch2o_t01.inp" = [{matcher="M086", tol=1.0E-12, ref=0.712276774819E+00}]
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"ch2o_t02.inp" = [{matcher="M086", tol=1.0E-12, ref=0.712276774819E+00}]
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"ch2o_t03.inp" = [{matcher="M086", tol=1.0E-12, ref=0.755534217819E+00}]
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"ch2o_t04.inp" = [{matcher="M086", tol=1.0E-12, ref=0.718756134707E+00}]
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#EOF
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