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. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 12-Oct-2021 | /Dimer_Pathway C | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -5474.1915937; Eh | |||
 | 12-Oct-2021 | /NiArCldppf B-2pyCl_NiCl2-pydppf | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -5474.2059792; Eh | |||
 | 12-Oct-2021 | /NiArCldppf B-3pyCl_NiCl3-pydppf | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -5474.2014928; Eh | |||
 | 12-Oct-2021 | /NiCODdppf NiCODdppf | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -5078.2884665; Eh | |||
 | 12-Oct-2021 | /ArX 4-pyCl | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -707.7555548; Eh | |||
 | 12-Oct-2021 | /dppf dppf | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -3258.1303362; Eh | |||
 | 12-Oct-2021 | /Dimer_Pathway 3-Cl | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -7690.3036531; Eh | |||
 | 12-Oct-2021 | /Nidppf_k1_Cl_ClAr Nidppfk1Cl2py | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -5474.1454407; Eh | |||
 | 12-Oct-2021 | /Nidppf_k1_Cl_ClAr Nidppfk1Cl3py | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -5474.1413251; Eh | |||
 | 12-Oct-2021 | /Nidppf_k1_Cl_ClAr Nidppfk1ClPh | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -5458.1037213; Eh |
Results 21-30 of 51 (Search time: 0.001 seconds).