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TEST_FILES
10 lines (10 loc) · 896 Bytes
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TEST_FILES
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almo-fullx.inp 11 1e-11 -137.653869649992146
almo-no-deloc.inp 11 9e-12 -137.557304848837759
s-almo-no-deloc.inp 11 2e-5 -376.101195076451177
s-almo-no-deloc-odd-ne.inp 11 2e-5 -115.255611348790495
FH-chain.inp 11 3e-10 -98.108319997143496
ion-pair.inp 11 5e-08 -115.006279639496825
LiF.inp 11 4e-12 -127.539319485641016
zero-electron-frag.inp 11 1e-08 -98.728605260047331
matrix-iterate.inp 11 1e-09 -127.379124535900814
#EOF