The iterative self-consistent reaction-field method: The refractive index of pure water

Publication: Research - peer-reviewJournal article – Annual report year: 2011

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The iterative self-consistent reaction-field method: The refractive index of pure water. / Sylvester-Hvid, Kristian O.; Mikkelsen, K.V.; Ratner, M.A.

In: International Journal of Quantum Chemistry, Vol. 111, No. 4, 2011, p. 904-913.

Publication: Research - peer-reviewJournal article – Annual report year: 2011

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Sylvester-Hvid, Kristian O.; Mikkelsen, K.V.; Ratner, M.A. / The iterative self-consistent reaction-field method: The refractive index of pure water.

In: International Journal of Quantum Chemistry, Vol. 111, No. 4, 2011, p. 904-913.

Publication: Research - peer-reviewJournal article – Annual report year: 2011

Bibtex

@article{e28cdf7c5c104ae095c4e75b38840e37,
title = "The iterative self-consistent reaction-field method: The refractive index of pure water",
keywords = "Biopolymers, Solar energy, Biopolymerer, Solenergi",
publisher = "John/Wiley & Sons, Inc. John/Wiley & Sons Ltd.",
author = "Sylvester-Hvid, {Kristian O.} and K.V. Mikkelsen and M.A. Ratner",
year = "2011",
doi = "10.1002/qua.22897",
volume = "111",
number = "4",
pages = "904--913",
journal = "International Journal of Quantum Chemistry",
issn = "0020-7608",

}

RIS

TY - JOUR

T1 - The iterative self-consistent reaction-field method: The refractive index of pure water

A1 - Sylvester-Hvid,Kristian O.

A1 - Mikkelsen,K.V.

A1 - Ratner,M.A.

AU - Sylvester-Hvid,Kristian O.

AU - Mikkelsen,K.V.

AU - Ratner,M.A.

PB - John/Wiley & Sons, Inc. John/Wiley & Sons Ltd.

PY - 2011

Y1 - 2011

N2 - We present different microscopic models for describing electromagnetic properties of condensed phases and the models involve iterative self-consistent procedures for calculating the properties. We report calculations of the frequency-dependent refractive index of pure water. We investigate the importance of the first solvation shell and nonequilibrium solvent configurations, and present a procedure for estimating appropriate cavity sizes. © 2010 Wiley Periodicals, Inc. Int J Quantum Chem, 2011

AB - We present different microscopic models for describing electromagnetic properties of condensed phases and the models involve iterative self-consistent procedures for calculating the properties. We report calculations of the frequency-dependent refractive index of pure water. We investigate the importance of the first solvation shell and nonequilibrium solvent configurations, and present a procedure for estimating appropriate cavity sizes. © 2010 Wiley Periodicals, Inc. Int J Quantum Chem, 2011

KW - Biopolymers

KW - Solar energy

KW - Biopolymerer

KW - Solenergi

U2 - 10.1002/qua.22897

DO - 10.1002/qua.22897

JO - International Journal of Quantum Chemistry

JF - International Journal of Quantum Chemistry

SN - 0020-7608

IS - 4

VL - 111

SP - 904

EP - 913

ER -