Zobrazeno 1 - 10
of 14
pro vyhledávání: '"Yury V. Matveychuk"'
Autor:
Yury V. Matveychuk, Sergey A. Sobalev, Polina I. Borisova, Ekaterina V. Bartashevich, Vladimir G. Tsirelson
Publikováno v:
Crystals, Vol 13, Iss 7, p 1147 (2023)
In order to understand the phenomenon of negative linear compressibility (NLC) in organic crystals, it is necessary to investigate not only the structural features but also the electronic changes taking place under external hydrostatic pressure. It i
Externí odkaz:
https://doaj.org/article/d531d38d79544db886c7a97901458fc0
Publikováno v:
Crystal Growth & Design. 22:6472-6482
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::936123eb65a3b6381237f83d85177dac
https://doi.org/10.1021/acs.cgd.2c00692
https://doi.org/10.1021/acs.cgd.2c00692
Autor:
Artëm E. Masunov, Meryl Wiratmo, Alexander A. Dyakov, Yury V. Matveychuk, Ekaterina V. Bartashevich
Publikováno v:
Crystal Growth & Design. 22:4546-4558
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::89ba616b162fa308ac50cedbd822ab97
https://doi.org/10.1021/acs.cgd.2c00449
https://doi.org/10.1021/acs.cgd.2c00449
Autor:
Artëm E. Masunov, Alexander A. Dyakov, Ekaterina V. Bartashevich, Yury V. Matveychuk, Meryl Wiratmo
Publikováno v:
Crystal Growth & Design. 20:6093-6100
We report on the development of a novel methodology for computational predictions of the mechanical properties for single crystals. This methodology is based on constrained optimization using dispe...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c88484485db3585969cf9c40c12b0a66
https://doi.org/10.1021/acs.cgd.0c00798
https://doi.org/10.1021/acs.cgd.0c00798
Publikováno v:
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials. 76:514-523
The inner-crystal quantum electronic pressure was estimated for unstrained C6Cl6, C6Br6, and C6I6 crystals and for those under external compression simulated from 1 to 20 GPa. The changes in its distribution were analyzed for the main structural elem
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::82d5d0d8ab1757078abd64706f101b33
https://doi.org/10.1107/s2052520620006113
https://doi.org/10.1107/s2052520620006113
Autor:
M. A. Polozov, F.V. Podgornov, Hua-Shu Hsu, D.E. Zhivulin, C. P. Sakthidharan, V. V. Avdin, Ekaterina V. Bartashevich, Dmitry A. Zherebtsov, Rainer Niewa, Feng Wei Guo, S. A. Nayfert, Vladimir E. Zhivulin, Yury V. Matveychuk, Adam I. Stash, S N Ivashevskaya, Yu-Sheng Chen, Martin U. Schmidt, S. V. Merzlov
Publikováno v:
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials. 75:384-392
The crystal structures of two polymorphs of cis-perinone (bisbenzimidazo[2,1-b:1′,2′-j]benzo[lmn][3,8]phenanthroline-6,9-dione, Pigment Red 194) were solved from single crystals obtained solvothermally from 1,2-dichlorobenzene or n-butanol at 220
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::213a059480e787cbc745f93003a9c3f5
https://doi.org/10.1107/s2052520619003287
https://doi.org/10.1107/s2052520619003287
Autor:
Uladzislava Dabranskaya, Alexander S. Novikov, Vadim Yu. Kukushkin, Daniil M. Ivanov, Nadezhda A. Bokach, Yury V. Matveychuk
Publikováno v:
Crystal Growth & Design. 19:1364-1376
The complexes trans-[PtCl2(NCNR2)2] (R2 = Me2 1, Et2 2, (CH2)4 3) were cocrystallized with CBr4 in CHCl3 (1 and 3) or in MeNO2 (2) forming adducts 1·CHCl3·CBr4, 2·2CBr4, and 3·2CBr4, respectively. In two out of three adducts, viz. 1·CHCl3·CBr4
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2fa3c153f3067c5bc80d42059a3d4efa
https://doi.org/10.1021/acs.cgd.8b01757
https://doi.org/10.1021/acs.cgd.8b01757
Autor:
Maria G. Khrenova, Ekaterina V. Bartashevich, Vladimir G. Tsirelson, Yury V. Matveychuk, S. A. Sobalev, Svetlana E. Mukhitdinova
Publikováno v:
Theoretical Chemistry Accounts. 139
We disclose the common trends for relationships between the binding energy and the local electronic properties at the bond critical points of electron density for the halogen, chalcogen, and pnictogen bonds in molecular complexes. Variations in the s
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::14b26f5c35883b6e316b79d6e01f9ddf
https://doi.org/10.1007/s00214-019-2534-y
https://doi.org/10.1007/s00214-019-2534-y
Publikováno v:
Crystal Growth & Design. 18:3366-3375
The stiffness tensor and elastic anisotropy characteristics for the crystalline hydrogen maleates of l-isoleucinium, l-leucinium, and l-norvalinium with l-norvaline have been calculated using the periodic DFT calculations and atom-centered basis sets
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c017a81af694e12492fe4922377af778
https://doi.org/10.1021/acs.cgd.8b00067
https://doi.org/10.1021/acs.cgd.8b00067
Publikováno v:
Molecules
Volume 24
Issue 6
Molecules, Vol 24, Iss 6, p 1083 (2019)
Volume 24
Issue 6
Molecules, Vol 24, Iss 6, p 1083 (2019)
The consideration of the disposition of minima of electron density and electrostatic potential along the line between non-covalently bound atoms in systems with Hal&minus
·
CH3&ndash
Y (Hal&minus
= Cl, Br
Y = N, O) frag
·
CH3&ndash
Y (Hal&minus
= Cl, Br
Y = N, O) frag
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::be4768887a23e63f91b3d2ca50964fb3