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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 30-Aug-2018 | IX1 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | RBP86 | 6-31g(d); sdd | -1098.50417907; Eh | |||
 | 30-Aug-2018 | IX2 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | RBP86 | 6-31g(d); sdd | -1174.94568574; Eh | |||
 | 30-Aug-2018 | nitrophenylazide | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | RBP86 | 6-31g(d) | -600.388598025; Eh | |||
 | 30-Aug-2018 | phenylazide | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | RBP86 | 6-31g(d) | -395.857319138; Eh | |||
 | 30-Aug-2018 | N2 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | RBP86 | 6-31g(d) | -109.523780034; Eh | |||
 | 30-Aug-2018 | VI2 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | UBP86 | 6-31g(d); sdd | -1190.97590447; Eh | |||
 | 30-Aug-2018 | VI3 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | UBP86 | 6-31g(d); sdd | -1190.97000581; Eh | |||
 | 30-Aug-2018 | VI1 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | UBP86 | 6-31g(d); sdd | -1114.53076775; Eh | |||
 | 30-Aug-2018 | VI4 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | UBP86 | 6-31g(d); sdd | -1114.53756269; Eh | |||
 | 30-Aug-2018 | VI5 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | UBP86 | 6-31g(d); sdd | -1114.53717283; Eh |
Results 1-10 of 32 (Search time: 0.001 seconds).