검색결과 : 4건
| No. | Article |
|---|---|
| 1 |
DFT Investigation of the eta(6) reversible arrow eta(6)-Inter-ring Haptotropic Rearrangement of the Group 8 Metals Complexes [(graphene)MCp](+) (M = Fe, Ru, Os) Gloriozov IP, Dem'yanov PI, Zhulyaev NS, Nechaev MS, Oprunenko YF, Gam F, Saillard JY, Kuznetsov AE Journal of Physical Chemistry A, 125(1), 366, 2021 |
| 2 |
Interacting quantum atoms (IQA) energy partition: The employing exact response CCSD density to benchmark density matrix functional approximations Polestshuk PM, Dem'yanov PI Chemical Physics Letters, 717, 136, 2019 |
| 3 |
A new determination of the standard molar enthalpy of formation of 2-chlorodibenzo-p-dioxin Lukyanova VA, Papina TS, Kolesov VP, Fedotov AN, Dem'yanov PI, Avramenko NV Journal of Chemical Thermodynamics, 35(9), 1507, 2003 |
| 4 |
Ab initio MO and density functional theory study of substituent effects on electron attachment to benzyl chlorides Dem'yanov PI, Myshakin EM, Boche G, Petrosyan VS, Alekseiko LN Journal of Physical Chemistry A, 103(51), 11469, 1999 |