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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required22-Dec-2021azaconazole_CONF18_octanolPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.08166497; Eh
Login required22-Dec-2021azaconazole_CONF4_octanolPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.08384100; Eh
Login required22-Dec-2021azaconazole_CONF7_octanolPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.08589111; Eh
Login required22-Dec-2021azaconazole_CONF17_octanolPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.08631603; Eh
Login required22-Dec-2021azaconazole_CONF6_octanolPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.08602154; Eh
Login required22-Dec-2021azaconazole_CONF2_octanolPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.08283981; Eh
Login required22-Dec-2021azaconazole_CONF10_waterPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.07738209; Eh
Login required22-Dec-2021azaconazole_CONF1_waterPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.07822204; Eh
Login required22-Dec-2021azaconazole_CONF11_waterPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.07746110; Eh
Login required22-Dec-2021azaconazole_CONF16_waterPla Terrada, PaulaOrca; 4.2.1; RELEASESingle point-def2-TZVPP-1699.07838748; Eh
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