Zobrazeno 1 - 10
of 53
pro vyhledávání: '"Yu. M. Kessler"'
Publikováno v:
Journal of Structural Chemistry. 45:643-647
Empirical pair potentials of water that take into account the contribution of the OH nonelectrostatic interaction in the hydrogen bond are considered. The effects of this contribution on the radial distribution functions derived by computer simulatio
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::683a4090b2b93d23f79c53a4944a34f5
https://doi.org/10.1007/s10947-005-0039-0
https://doi.org/10.1007/s10947-005-0039-0
Publikováno v:
Russian Chemical Bulletin. 52:330-335
The influence of parameters of rigid models of the 12-6-1 type on the properties calculated in computer experiments, viz., radial distribution functions and internal energy, was studied by the method of step-by-step transform of the water models supp
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::85189deb72f9e4a756edeb4c06c96005
https://doi.org/10.1023/a:1023442312566
https://doi.org/10.1023/a:1023442312566
Publikováno v:
Doklady Physical Chemistry. 382:55-58
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::398b6e872a533ea356577135d7d0b755
https://doi.org/10.1023/a:1014407531345
https://doi.org/10.1023/a:1014407531345
Publikováno v:
Scopus-Elsevier
A simple method for determination of the angular orientation of water molecules in the first coordination sphere from the radial distribution functions is proposed. A comparative analysis of the ability of the model potentials of pair interaction to
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::811ae4388bbae9efaca6c72e861136ca
https://doi.org/10.1007/bf02494915
https://doi.org/10.1007/bf02494915
Publikováno v:
Scopus-Elsevier
The effect of variation of the potential function on the structural and dynamic properties of model water when the surface of pair interactions is invariant is studied by the molecular dynamics method. Variations for the rigid and polarizable models
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::879c534903a5c0624554836d58ec72c1
https://doi.org/10.1007/bf02903653
https://doi.org/10.1007/bf02903653
Autor:
Yu. M. Kessler
Publikováno v:
Journal of Structural Chemistry. 25:244-248
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::0d8be23c90324e7b41e6efe4a1b148cc
https://doi.org/10.1007/bf00747351
https://doi.org/10.1007/bf00747351
Publikováno v:
Journal of Structural Chemistry. 23:629-632
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8dd03c92e7d68a7e2b8ab3c4143e58c0
https://doi.org/10.1007/bf00746175
https://doi.org/10.1007/bf00746175
Publikováno v:
Journal of Structural Chemistry. 24:869-872
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a9dfe2e08e897c30f8eed3870377052e
https://doi.org/10.1007/bf00755547
https://doi.org/10.1007/bf00755547
Autor:
A. I. Mishustin, Yu. M. Kessler
Publikováno v:
Journal of Solution Chemistry. 4:779-790
The spin-lattice relaxation time (T1) of7Li+ was measured in solutions of LiCl and LiClO4 in protic (MeOH, EtOH,n-PrOH,i-PrOH,n-BuOH, sec-BuOH, formamide, N-methylformamide) and aprotic (MeCN, acetone, methyl ethyl ketone, propylene carbonate, dimeth
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8630a091e126529a04d413955142e4c6
https://doi.org/10.1007/bf00650533
https://doi.org/10.1007/bf00650533
Autor:
A. I. Mishustin, Yu. M. Kessler
Publikováno v:
Journal of Structural Chemistry. 15:191-194
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::823b2bb58a70b2ef464da7d554cc7654
https://doi.org/10.1007/bf00746555
https://doi.org/10.1007/bf00746555