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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 15-Oct-2018 | NCCH3-OPBE | Fernández, Víctor | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | ROPBE | 6-31+g(d) | -132.709181451; Eh | |||
 | 15-Oct-2018 | 7_1-OPBE | Fernández, Víctor | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | ROPBE | 6-31+g(d) | -1304.38099645; Eh | |||
 | 15-Oct-2018 | CH2O-OPBE | Fernández, Víctor | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | ROPBE | 6-31+g(d) | -114.456340312; Eh | |||
 | 15-Oct-2018 | H2O-OPBE | Fernández, Víctor | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | ROPBE | 6-31+g(d) | -76.3924039326; Eh | |||
 | 15-Oct-2018 | CO2-OPBE | Fernández, Víctor | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | ROPBE | 6-31+g(d) | -188.507552486; Eh |
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