Zobrazeno 1 - 5
of 5
pro vyhledávání: '"Alexander A. Oskorbin"'
Autor:
Alexander V. Belyakov, Natalja Vogt, Jean Demaison, Roman Yu. Kulishenko, Alexander A. Oskorbin
Publikováno v:
Chemical Physics Letters. 795:139540
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6d1885a37cd4dd7a6a738f1f03949b78
https://doi.org/10.1016/j.cplett.2022.139540
https://doi.org/10.1016/j.cplett.2022.139540
Autor:
Igor F. Shishkov, Kirill O. Nikolaenko, Alexander A. Oskorbin, Anatolii N. Rykov, Natalja Vogt, Alexander V. Belyakov
Publikováno v:
Molecular Physics. 117:1850-1857
The molecular structure of 1-methylisatin (1) has been studied by gas-phase electron diffraction (GED) and quantum chemical computation up to the coupled cluster (CCSD(T)) level of theory. The semiexperimental equilibrium structure (Cs point group sy
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1dc557cce84fa96f71fecf98eb3607b9
https://doi.org/10.1080/00268976.2018.1554193
https://doi.org/10.1080/00268976.2018.1554193
Autor:
Vladimir V. Kuznetsov, Alexander A. Oskorbin, Vitalii A. Losev, Leonid L. Fershtat, Anatolii N. Rykov, Nina N. Makhova, Igor F. Shishkov, Alexander A. Larin, Alexander V. Belyakov
Publikováno v:
Journal of Molecular Structure. 1222:128856
The equilibrium molecular structures of the isomeric 3-methyl-4-nitro- and 4-methyl-3-nitrofuroxans have been determined for the first time by gas-phase electron diffraction (GED) supported by coupled cluster calculations up to CCSD(T)/cc-pVTZ level
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::887a6c06554cacda26c8a1347cbf0acc
https://doi.org/10.1016/j.molstruc.2020.128856
https://doi.org/10.1016/j.molstruc.2020.128856
Semiexperimental (SE) equilibrium molecular structures of the title compounds are determined using rotational and ab initio data. Cubic force constants for the parent molecules and a number of isotopologues are calculated at the B2PLYP double hybrid
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7c767bc2ec15916b8c11660a36f04030
Autor:
A. D. Ivanov, A. N. Khramov, Alexander V. Belyakov, Vitalii A. Losev, L. M. Pevzner, M. L. Petrov, Alexander A. Oskorbin
Publikováno v:
Russian Journal of Physical Chemistry A. 92:1441-1442
The mutual influence of atoms and atomic groups is one of the most important problems of structural chemistry. Gas-phase electron diffraction allows us to obtain the geometrical parameters of molecules that describe them most accurately in the free s
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f36058ecea329ac2c13d8e7c34345d34
https://doi.org/10.1134/s0036024418070075
https://doi.org/10.1134/s0036024418070075