srDFT_G2/G09/Small_core/Molecules/vtz
2019-03-28 00:25:00 +01:00
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BeH.inp added Small core data CC 2019-03-28 00:25:00 +01:00
BeH.out added Small core data CC 2019-03-28 00:25:00 +01:00
BeH.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
C2H2.inp added Small core data CC 2019-03-28 00:25:00 +01:00
C2H2.out added Small core data CC 2019-03-28 00:25:00 +01:00
C2H2.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
C2H4.inp added Small core data CC 2019-03-28 00:25:00 +01:00
C2H4.out added Small core data CC 2019-03-28 00:25:00 +01:00
C2H4.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
C2H6.inp added Small core data CC 2019-03-28 00:25:00 +01:00
C2H6.out added Small core data CC 2019-03-28 00:25:00 +01:00
C2H6.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
ccsdt_sc_vtz.template added Small core data CC 2019-03-28 00:25:00 +01:00
CH.inp added Small core data CC 2019-03-28 00:25:00 +01:00
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CH4O.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
Cl2.inp added Small core data CC 2019-03-28 00:25:00 +01:00
Cl2.out added Small core data CC 2019-03-28 00:25:00 +01:00
Cl2.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
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ClO.out added Small core data CC 2019-03-28 00:25:00 +01:00
ClO.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
CN.inp added Small core data CC 2019-03-28 00:25:00 +01:00
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CO2.inp added Small core data CC 2019-03-28 00:25:00 +01:00
CO2.out added Small core data CC 2019-03-28 00:25:00 +01:00
CO2.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
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CS.inp added Small core data CC 2019-03-28 00:25:00 +01:00
CS.out added Small core data CC 2019-03-28 00:25:00 +01:00
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H2O.out added Small core data CC 2019-03-28 00:25:00 +01:00
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HCN.out added Small core data CC 2019-03-28 00:25:00 +01:00
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HCO.inp added Small core data CC 2019-03-28 00:25:00 +01:00
HCO.out added Small core data CC 2019-03-28 00:25:00 +01:00
HCO.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
HF.inp added Small core data CC 2019-03-28 00:25:00 +01:00
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HOCl.out added Small core data CC 2019-03-28 00:25:00 +01:00
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Li2.inp added Small core data CC 2019-03-28 00:25:00 +01:00
Li2.out added Small core data CC 2019-03-28 00:25:00 +01:00
Li2.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
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LiH.out added Small core data CC 2019-03-28 00:25:00 +01:00
LiH.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
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NaCl.out added Small core data CC 2019-03-28 00:25:00 +01:00
NaCl.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
NH.inp added Small core data CC 2019-03-28 00:25:00 +01:00
NH.out added Small core data CC 2019-03-28 00:25:00 +01:00
NH.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
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NH2.out added Small core data CC 2019-03-28 00:25:00 +01:00
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NH3.out added Small core data CC 2019-03-28 00:25:00 +01:00
NH3.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
NO.inp added Small core data CC 2019-03-28 00:25:00 +01:00
NO.out added Small core data CC 2019-03-28 00:25:00 +01:00
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O2.out added Small core data CC 2019-03-28 00:25:00 +01:00
O2.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
OH.inp added Small core data CC 2019-03-28 00:25:00 +01:00
OH.out added Small core data CC 2019-03-28 00:25:00 +01:00
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PH2.out added Small core data CC 2019-03-28 00:25:00 +01:00
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S2.out added Small core data CC 2019-03-28 00:25:00 +01:00
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Si2.out added Small core data CC 2019-03-28 00:25:00 +01:00
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SiO.out added Small core data CC 2019-03-28 00:25:00 +01:00
SiO.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
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SO.inp added Small core data CC 2019-03-28 00:25:00 +01:00
SO.out added Small core data CC 2019-03-28 00:25:00 +01:00
SO.xyz added Small core data CC 2019-03-28 00:25:00 +01:00
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SO2.xyz added Small core data CC 2019-03-28 00:25:00 +01:00