Explicit solvent simulations of the aqueous oxidation potential and aqueous reorganization energy for neutral organic compounds: Gas phase, linear solvent response, and non-linear response contributions

Jennifer J. Guerard, Peter Rudolf Tentscher, Marianne Seijo, J. Samuel Arey

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14 Citationer (Scopus)
OriginalsprogEngelsk
TidsskriftPhysical Chemistry Chemical Physics
Vol/bind17
Udgave nummer22
Sider (fra-til)14811-14826
ISSN1463-9076
DOI
StatusUdgivet - 2015
Udgivet eksterntJa

Citer dette

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title = "Explicit solvent simulations of the aqueous oxidation potential and aqueous reorganization energy for neutral organic compounds: Gas phase, linear solvent response, and non-linear response contributions",
author = "Guerard, {Jennifer J.} and Tentscher, {Peter Rudolf} and Marianne Seijo and Arey, {J. Samuel}",
year = "2015",
doi = "10.1039/C4CP04760E",
language = "English",
volume = "17",
pages = "14811--14826",
journal = "Physical Chemistry Chemical Physics",
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publisher = "Royal Society of Chemistry",
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Explicit solvent simulations of the aqueous oxidation potential and aqueous reorganization energy for neutral organic compounds: Gas phase, linear solvent response, and non-linear response contributions. / Guerard, Jennifer J.; Tentscher, Peter Rudolf; Seijo, Marianne; Arey, J. Samuel.

I: Physical Chemistry Chemical Physics, Bind 17, Nr. 22, 2015, s. 14811-14826.

Publikation: Bidrag til tidsskriftTidsskriftartikelForskningpeer review

TY - JOUR

T1 - Explicit solvent simulations of the aqueous oxidation potential and aqueous reorganization energy for neutral organic compounds: Gas phase, linear solvent response, and non-linear response contributions

AU - Guerard, Jennifer J.

AU - Tentscher, Peter Rudolf

AU - Seijo, Marianne

AU - Arey, J. Samuel

PY - 2015

Y1 - 2015

U2 - 10.1039/C4CP04760E

DO - 10.1039/C4CP04760E

M3 - Journal article

VL - 17

SP - 14811

EP - 14826

JO - Physical Chemistry Chemical Physics

JF - Physical Chemistry Chemical Physics

SN - 1463-9076

IS - 22

ER -