검색결과 : 26건
| No. | Article |
|---|---|
| 1 |
Purely Spectroscopic Determination of the Spin Hamiltonian Parameters in High-Spin Six-Coordinated Cobalt(II) Complexes with Large Zero-Field Splitting Misochko EY, Akimov AV, Korchagin DV, Nehrkorn J, Ozerov M, Palii AV, Clemente-Juan JM, Aldoshin SM Inorganic Chemistry, 58(24), 16434, 2019 |
| 2 |
Steric Heavy Atom Effect on Magnetic Anisotropy of Triplet Tribromophenyl Nitrenes Korchagin DV, Akimov AV, Savitsky A, Chapyshev SV, Aldoshin SM, Misochko EY Journal of Physical Chemistry A, 122(45), 8931, 2018 |
| 3 |
Unexpected effect of substituents on the zero-field splitting of triplet phenyl nitrenes Korchagin DV, Akimov AV, Yureva EA, Aldoshin SM, Misochko EY Chemical Physics Letters, 659, 234, 2016 |
| 4 |
Single-Ion Magnet Et4N[Co-II(hfac)(3)] with Nonuniaxial Anisotropy: Synthesis, Experimental Characterization, and Theoretical Modeling Palii AV, Korchagin DV, Yureva EA, Akimov AV, Misochko EY, Shilov GV, Talantsev AD, Morgunov RB, Aldoshin SM, Tsukerblat BS Inorganic Chemistry, 55(19), 9696, 2016 |
| 5 |
Dependence of Nonadiabatic Couplings with Kohn-Sham Orbitals on the Choice of Density Functional: Pure vs Hybrid Lin YH, Akimov AV Journal of Physical Chemistry A, 120(45), 9028, 2016 |
| 6 |
Large-Scale Computations in Chemistry: A Bird's Eye View of a Vibrant Field Akimov AV, Prezhdo OV Chemical Reviews, 115(12), 5797, 2015 |
| 7 |
Heavy Atom Effect on Magnetic Anisotropy of Matrix-Isolated Monobromine Substituted Septet Trinitrene Misochko EY, Masitov AA, Akimov AV, Korchagin DV, Chapyshev SV Journal of Physical Chemistry A, 119(11), 2413, 2015 |
| 8 |
Theoretical Insights into the Impact of Ru Catalyst Anchors on the Efficiency of Photocatalytic CO2 Reduction on Ta2O5 Akimov AV, Jinnouchi R, Shirai S, Asahi R, Prezhdo OV Journal of Physical Chemistry B, 119(24), 7186, 2015 |
| 9 |
What Makes the Photocatalytic CO2 Reduction on N-Doped Ta2O5 Efficient: Insights from Nonadiabatic Molecular Dynamics Akimov AV, Asahi R, Jinnouchi R, Prezhdo OV Journal of the American Chemical Society, 137(35), 11517, 2015 |
| 10 |
Low fraction of hexagonal inclusions in thick and bulk cubic GaN layers Waheeda SN, Zainal N, Hassan Z, Novikov SV, Akimov AV, Kent AJ Applied Surface Science, 317, 1010, 2014 |