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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
2-Aug-2018 | MDsnap_trimer3_2440 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2223.53145882; eV | ||||
2-Aug-2018 | MDsnap_trimer3_2640 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2224.19315288; eV | ||||
2-Aug-2018 | MDsnap_trimer3_2620 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2225.71611413; eV | ||||
2-Aug-2018 | MDsnap_trimer3_2660 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2222.48671665; eV | ||||
2-Aug-2018 | MDsnap_trimer3_2420 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2224.17569962; eV | ||||
2-Aug-2018 | MDsnap_trimer3_2600 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2224.57176296; eV | ||||
2-Aug-2018 | MDsnap_trimer3_2400 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2223.43470781; eV | ||||
2-Aug-2018 | MDsnap_trimer3_2380 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2222.88287899; eV | ||||
2-Aug-2018 | MDsnap_trimer3_2560 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2222.63100825; eV | ||||
2-Aug-2018 | MDsnap_trimer2_3240 | Fako, Edvin | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex | Single point | DFT | - | -2221.39807545; eV |
Results 11-20 of 1698 (Search time: 0.002 seconds).