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srDFT_G2/Ref/Molecules/g09
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Pierre-Francois Loos 54ec812690 g09 files
2019-03-25 22:47:41 +01:00
..
BeH.inp
g09 files
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BeH.xyz
g09 input
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C2H2.inp
g09 files
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C2H2.xyz
g09 input
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C2H4.inp
g09 files
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C2H4.xyz
g09 input
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C2H6.inp
g09 files
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C2H6.xyz
g09 input
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ccsdt_fc_vdz.template
g09 files
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CH2_1A1.inp
g09 files
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CH2_1A1.xyz
g09 input
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CH2_3B1.inp
g09 files
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CH2_3B1.xyz
g09 input
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CH3.inp
g09 files
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CH3.xyz
g09 input
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CH3Cl.inp
g09 files
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CH3Cl.xyz
g09 input
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CH3SH.inp
g09 files
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CH3SH.xyz
g09 input
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CH4.inp
g09 files
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CH4.xyz
g09 input
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CH4O.inp
g09 files
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CH4O.xyz
g09 input
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CH.inp
g09 files
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CH.xyz
g09 input
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Cl2.inp
g09 files
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Cl2.xyz
g09 input
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ClF.inp
g09 files
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ClF.xyz
g09 input
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ClO.inp
g09 files
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ClO.xyz
g09 input
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CN.inp
g09 files
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CN.xyz
g09 input
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CO2.inp
g09 files
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CO2.xyz
g09 input
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CO.inp
g09 files
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CO.xyz
g09 input
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create_input.sh
g09 files
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CS.inp
g09 files
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CS.xyz
g09 input
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F2.inp
g09 files
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F2.xyz
g09 input
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H2CO.inp
g09 files
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H2CO.xyz
g09 input
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H2O2.inp
g09 files
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H2O2.xyz
g09 input
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H2O.inp
g09 files
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H2O.xyz
g09 input
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H2S.inp
g09 files
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H2S.xyz
g09 input
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H3COH.inp
g09 files
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H3COH.xyz
g09 input
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H3CSH.inp
g09 files
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H3CSH.xyz
g09 input
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HCl.inp
g09 files
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HCl.xyz
g09 input
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HCN.inp
g09 files
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HCN.xyz
g09 input
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HCO.inp
g09 files
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HCO.xyz
g09 input
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HF.inp
g09 files
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HF.xyz
g09 input
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HOCl.inp
g09 files
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HOCl.xyz
g09 input
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Li2.inp
g09 files
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Li2.xyz
g09 input
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LiF.inp
g09 files
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LiF.xyz
g09 input
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LiH.inp
g09 files
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LiH.xyz
g09 input
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N2.inp
g09 files
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N2.xyz
g09 input
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N2H4.inp
g09 files
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N2H4.xyz
g09 input
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Na2.inp
g09 files
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Na2.xyz
g09 input
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NaCl.inp
g09 files
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NaCl.xyz
g09 input
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NH2.inp
g09 files
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NH2.xyz
g09 input
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NH3.inp
g09 files
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NH3.xyz
g09 input
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NH.inp
g09 files
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NH.xyz
g09 input
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NO.inp
g09 files
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NO.xyz
g09 input
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O2.inp
g09 files
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O2.xyz
g09 input
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OH.inp
g09 files
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OH.xyz
g09 input
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P2.inp
g09 files
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P2.xyz
g09 input
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PH2.inp
g09 files
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PH2.xyz
g09 input
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PH3.inp
g09 files
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PH3.xyz
g09 input
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run_g09.sh
g09 files
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S2.inp
g09 files
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S2.xyz
g09 input
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Si2.inp
g09 files
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Si2.xyz
g09 input
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Si2H6.inp
g09 files
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Si2H6.xyz
g09 input
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SiH2_1A1.inp
g09 files
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SiH2_1A1.xyz
g09 input
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SiH2_3B1.inp
g09 files
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SiH2_3B1.xyz
g09 input
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SiH3.inp
g09 files
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SiH3.xyz
g09 input
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SiH4.inp
g09 files
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SiH4.xyz
g09 input
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SiO.inp
g09 files
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SiO.xyz
g09 input
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SO2.inp
g09 files
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SO2.xyz
g09 input
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SO.inp
g09 files
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SO.xyz
g09 input
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