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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
![]() | 2-Mar-2019 | Monoterpenes-11-M06-2X_6-31+(d,p) | Pahima, Efrat | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -390.508499033; Eh | |||
![]() | 2-Mar-2019 | Monoterpenes-08-M06-2X_6-31+(d,p) | Pahima, Efrat | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -390.515835460; Eh | |||
![]() | 2-Mar-2019 | Monoterpenes-04-M06-2X | Pahima, Efrat | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | - | |||
![]() | 2-Mar-2019 | Monoterpenes-02-M06-2X | Pahima, Efrat | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -390.518965651; Eh | |||
![]() | 2-Mar-2019 | Monoterpenes-31-M06-2X_6-31+(d,p) | Pahima, Efrat | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -390.498436756; Eh | |||
![]() | 2-Mar-2019 | Monoterpenes-30-M06-2X_6-31+(d,p) | Pahima, Efrat | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -390.500030188; Eh | |||
![]() | 2-Mar-2019 | Monoterpenes-15-M06-2X_6-31+(d,p) | Pahima, Efrat | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | RM062X | - | -390.507504237; Eh | |||
![]() | 2-Mar-2019 | Monoterpenes-06-M06-2X_6-31+(d,p) | Pahima, Efrat | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -390.511036791; Eh | |||
![]() | 2-Mar-2019 | Monoterpenes-05-M06-2X | Pahima, Efrat | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -390.511137018; Eh | |||
![]() | 2-Mar-2019 | Monoterpenes-50-M06-2X_6-31+(d,p) | Pahima, Efrat | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -390.452683517; Eh |
Results 31-40 of 78 (Search time: 0.001 seconds).