Structure of Irradiated Polytetrafluoroethylene According to DFT Calculations of NMR Chemical Shifts Full article
Journal |
Journal of Structural Chemistry
ISSN: 0022-4766 , E-ISSN: 1573-8779 |
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Output data | Year: 2005, Volume: 46, Number: 1, Pages: 87-92 Pages count : 6 DOI: 10.1007/s10947-006-0012-6 | ||||||
Tags | NMR chemical shift, Polytetrafluoroethylene, Quantum chemical computations, Radiation exposure | ||||||
Authors |
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Affiliations |
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Funding (1)
1 | Siberian Branch of the Russian Academy of Sciences | 159 |
Abstract:
Methods of density functional theory were used to calculate 1H, 13C, and 19F magnetic shielding tensors for C7FnHmOl model molecules, which can arise as fragments from radiation exposure of polytetrafluoroethylene.
Cite:
Buznik V.M.
, Gabuda S.P.
, Kozlova S.G.
, Ignatieva L.N.
Structure of Irradiated Polytetrafluoroethylene According to DFT Calculations of NMR Chemical Shifts
Journal of Structural Chemistry. 2005. V.46. N1. P.87-92. DOI: 10.1007/s10947-006-0012-6 WOS Scopus РИНЦ
Structure of Irradiated Polytetrafluoroethylene According to DFT Calculations of NMR Chemical Shifts
Journal of Structural Chemistry. 2005. V.46. N1. P.87-92. DOI: 10.1007/s10947-006-0012-6 WOS Scopus РИНЦ
Original:
Бузник В.М.
, Габуда С.П.
, Козлова С.Г.
, Игнатьева Л.Н.
Строение радиационно облученного политетрафторэтилена по данным DFT расчетов химического сдвига ЯМР
Журнал структурной химии. 2005. Т.46. №1. С.90-95. РИНЦ
Строение радиационно облученного политетрафторэтилена по данным DFT расчетов химического сдвига ЯМР
Журнал структурной химии. 2005. Т.46. №1. С.90-95. РИНЦ
Dates:
Submitted: | Oct 29, 2003 |
Published print: | Jan 1, 2005 |
Identifiers:
Web of science | WOS:000237363900012 |
Scopus | 2-s2.0-33744998347 |
Elibrary | 13474285 |
Chemical Abstracts | 2006:474187 |
Chemical Abstracts (print) | 146:229833 |
OpenAlex | W2078963751 |