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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 9-Nov-2018 | /vacuum/complexes sime3cunh33 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -776.170508649; Eh | |||
 | 9-Nov-2018 | /vacuum/complexes scunh33 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -765.273155397; Eh | |||
 | 9-Nov-2018 | /vacuum/complexes pme3fecl2sextup | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -1505.28184039; Eh | |||
 | 9-Nov-2018 | /vacuum/complexes pme3cunh33 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -827.684601535; Eh | |||
 | 9-Nov-2018 | /vacuum/complexes pf3cunh33 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -1007.47755786; Eh | |||
 | 9-Nov-2018 | /vacuum/complexes nh3cunh33 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -423.108573725; Eh | |||
 | 9-Nov-2018 | /vacuum/complexes ncsfecl2sextup | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -1535.48034559; Eh | |||
 | 9-Nov-2018 | /vacuum/complexes ncscunh33 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -857.947935013; Eh | |||
 | 9-Nov-2018 | /vacuum/complexes nchcunh33 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -459.964873029; Eh | |||
 | 9-Nov-2018 | /vacuum/complexes fenilcunh33 | Besora, Maria | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | UB3LYP | 6-31+g*; sdd | -598.533197924; Eh |
Results 341-350 of 371 (Search time: 0.001 seconds).