Research output: Contribution to journal › Article › peer-review
Charge States of Sorption Centers in Matrimid. / Petrov, Andrey; Toikka, Alexander.
In: Glass Physics and Chemistry, Vol. 46, No. 2, 01.03.2020, p. 186-188.Research output: Contribution to journal › Article › peer-review
}
TY - JOUR
T1 - Charge States of Sorption Centers in Matrimid
AU - Petrov, Andrey
AU - Toikka, Alexander
N1 - Petrov, A.V., Toikka, A.M. Charge States of Sorption Centers in Matrimid. Glass Phys Chem 46, 186–188 (2020). https://doi.org/10.1134/S1087659620020091
PY - 2020/3/1
Y1 - 2020/3/1
N2 - Abstract: The features of the electronic structure of Matrimid, which are important for assessing the sorption ability of the specified polymer as a membrane material, are considered. Using the density functional theory, the charge states of sorption centers in the Matrimid are calculated. The most probable polymer atoms responsible for nonvalent interactions of polar molecules of gases or liquids when passing through membranes based on this polymer are investigated.
AB - Abstract: The features of the electronic structure of Matrimid, which are important for assessing the sorption ability of the specified polymer as a membrane material, are considered. Using the density functional theory, the charge states of sorption centers in the Matrimid are calculated. The most probable polymer atoms responsible for nonvalent interactions of polar molecules of gases or liquids when passing through membranes based on this polymer are investigated.
KW - density functional theory
KW - Matrimid
KW - ELECTRONIC POPULATION ANALYSIS
KW - POLYIMIDE
KW - GENERALIZED GRADIENT APPROXIMATION
UR - http://www.scopus.com/inward/record.url?scp=85084349891&partnerID=8YFLogxK
UR - https://www.mendeley.com/catalogue/85cc0223-59be-3561-ad75-324ce8c51696/
U2 - 10.1134/S1087659620020091
DO - 10.1134/S1087659620020091
M3 - Article
AN - SCOPUS:85084349891
VL - 46
SP - 186
EP - 188
JO - Glass Physics and Chemistry
JF - Glass Physics and Chemistry
SN - 1087-6596
IS - 2
ER -
ID: 70659019