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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg23-Dec-2022piperalin_CONF282_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle point-def2-TZVPP-1748.08934556; Eh
thumbnail.jpeg18-Jan-2023cafenstrole_CONF80_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle point-def2-TZVPP-1465.94200268; Eh
thumbnail.jpeg18-Jan-2023cafenstrole_CONF79_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle point-def2-TZVPP-1465.94272331; Eh
thumbnail.jpeg7-Oct-2022amisulbrom_CONF34_gasPulgar Rubio, AntonioOrca; 4.2.1; RELEASESingle point-def2-TZVPP-4548.37971806; Eh
thumbnail.jpeg8-Oct-2022ametoctradin_CONF1029_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle point-def2-TZVPP-860.51133446; Eh
thumbnail.jpeg8-Oct-2022ametoctradin_CONF1028_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle point-def2-TZVPP-860.51163404; Eh
thumbnail.jpeg18-Jan-2023pethoxamid_CONF40_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle point-def2-TZVPP-1288.42446673; Eh
thumbnail.jpeg7-Oct-2022amisulbrom_CONF27_gasPulgar Rubio, AntonioOrca; 4.2.1; RELEASESingle point-def2-TZVPP-4548.37992046; Eh
thumbnail.jpeg27-Sep-2022enoxystrobin_CONF11_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle point-def2-TZVPP-1667.45686423; Eh
thumbnail.jpeg18-Jan-2023pethoxamid_CONF4_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle point-def2-TZVPP-1288.42772997; Eh
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