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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg1-Jun-2022K_accLaconsay, CroixGaussian; 16; ES64L-G16RevA.03Geometry optimization Minimum-DEF2SVP-1598.22455525; Eh
thumbnail.jpeg1-Jun-2022F_accLaconsay, CroixGaussian; 16; ES64L-G16RevC.01Geometry optimization Minimum-DEF2SVP-1598.21590532; Eh
thumbnail.jpeg1-Jun-2022A_accLaconsay, CroixGaussian; 16; AS64L-G16RevC.01Geometry optimization Minimum-DEF2SVP-572.013462141; Eh
thumbnail.jpeg1-Jun-2022Int_U_2Laconsay, CroixGaussian; 16; ES64L-G16RevC.01Geometry optimization Minimum-DEF2SVP-1176.06187035; Eh
thumbnail.jpeg1-Jun-2022K_don_c7_meLaconsay, CroixGaussian; 16; ES64L-G16RevA.03Geometry optimization Minimum-DEF2SVP-1716.03383198; Eh
thumbnail.jpeg1-Jun-2022I_acc_c7_meLaconsay, CroixGaussian; 16; ES64L-G16RevA.03Geometry optimization Minimum-DEF2SVP-1637.52732690; Eh
thumbnail.jpeg1-Jun-2022F_acc_c7_meLaconsay, CroixGaussian; 16; ES64L-G16RevA.03Geometry optimization Minimum-DEF2SVP-1637.54037195; Eh
thumbnail.jpeg1-Jun-2022B_donLaconsay, CroixGaussian; 16; ES64L-G16RevC.01Geometry optimization Minimum-DEF2SVP-650.488483750; Eh
thumbnail.jpeg1-Jun-2022H_donLaconsay, CroixGaussian; 16; AS64L-G16RevC.01Geometry optimization Minimum-DEF2SVP-1676.63547236; Eh
thumbnail.jpeg1-Jun-2022D_donLaconsay, CroixGaussian; 16; ES64L-G16RevC.01Geometry optimization Minimum-DEF2SVP-1676.69809672; Eh
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