Search
Add filters:
Use filters to refine the search results.
Item hits:
Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
![]() | 27-Sep-2021 | SCO_OLYP_S11_HS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UOLYP | DEF2TZVP | -8014.64392864; Eh | |||
![]() | 27-Sep-2021 | SCO_OLYP_S7_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UOLYP | DEF2TZVP | -5117.84444771; Eh | |||
![]() | 27-Sep-2021 | SCO_OLYP_S9_HS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UOLYP | DEF2TZVP | -3114.22778335; Eh | |||
![]() | 27-Sep-2021 | SCO_OLYP_S9_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UOLYP | DEF2TZVP | -3114.22264484; Eh | |||
![]() | 27-Sep-2021 | SCO_OLYP_S7_HS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UOLYP | DEF2TZVP | -5117.84620550; Eh | |||
![]() | 27-Sep-2021 | SCO_OLYP_S10_HS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UOLYP | DEF2TZVP | -2718.79841881; Eh | |||
![]() | 27-Sep-2021 | SCO_OLYP_S8_HS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UOLYP | DEF2TZVP | -2790.85919622; Eh | |||
![]() | 27-Sep-2021 | SCO_OLYP_S10_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Minimum | UOLYP | DEF2TZVP | -2718.79347243; Eh | |||
![]() | 27-Sep-2021 | SCO_OLYP_S8_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UOLYP | DEF2TZVP | -2790.85479753; Eh | |||
![]() | 27-Sep-2021 | SCO_OLYP_S18_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UOLYP | DEF2TZVP | -2831.91536842; Eh |
Results 1-10 of 38 (Search time: 0.001 seconds).
Discover
Subject