том 262 издание 6 страницы 797-800

1H, 13C and 17O principal hyperfine tensor determination for the p-benzosemiquinone anion radical using hybrid density functional methods

Тип публикацииJournal Article
Дата публикации1996-11-01
scimago Q2
wos Q2
БС2
SJR0.546
CiteScore5.9
Impact factor3.1
ISSN00092614, 18734448
Physical and Theoretical Chemistry
General Physics and Astronomy
Краткое описание
The 1 H, 13 C and 17 O hyperfine coupling tensors for the p-benzosemiquinone anion radical have been directly calculated using hybrid density functional methods. Excellent agreement between experimentally determined tensor values and theoretically calculated ones are reported. Proton tensors for solvent hydrogen bonding interactions with an alcohol solvent are also well reproduced.
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ГОСТ |
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O’Malley P. M. 1H, 13C and 17O principal hyperfine tensor determination for the p-benzosemiquinone anion radical using hybrid density functional methods // Chemical Physics Letters. 1996. Vol. 262. No. 6. pp. 797-800.
ГОСТ со всеми авторами (до 50) Скопировать
O’Malley P. M. 1H, 13C and 17O principal hyperfine tensor determination for the p-benzosemiquinone anion radical using hybrid density functional methods // Chemical Physics Letters. 1996. Vol. 262. No. 6. pp. 797-800.
RIS |
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TY - JOUR
DO - 10.1016/S0009-2614(96)01146-3
UR - https://doi.org/10.1016/S0009-2614(96)01146-3
TI - 1H, 13C and 17O principal hyperfine tensor determination for the p-benzosemiquinone anion radical using hybrid density functional methods
T2 - Chemical Physics Letters
AU - O’Malley, Patrick M.
PY - 1996
DA - 1996/11/01
PB - Elsevier
SP - 797-800
IS - 6
VL - 262
SN - 0009-2614
SN - 1873-4448
ER -
BibTex |
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BibTex (до 50 авторов) Скопировать
@article{1996_Omalley,
author = {Patrick M. O’Malley},
title = {1H, 13C and 17O principal hyperfine tensor determination for the p-benzosemiquinone anion radical using hybrid density functional methods},
journal = {Chemical Physics Letters},
year = {1996},
volume = {262},
publisher = {Elsevier},
month = {nov},
url = {https://doi.org/10.1016/S0009-2614(96)01146-3},
number = {6},
pages = {797--800},
doi = {10.1016/S0009-2614(96)01146-3}
}
MLA
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Omalley, Patrick J.. “1H, 13C and 17O principal hyperfine tensor determination for the p-benzosemiquinone anion radical using hybrid density functional methods.” Chemical Physics Letters, vol. 262, no. 6, Nov. 1996, pp. 797-800. https://doi.org/10.1016/S0009-2614(96)01146-3.