Field-induced coordinates for the determination of dynamic vibrational nonlinear optical properties

Josep M. Luis; Miquel Duran; Bernard Kirtman

doi:10.1063/1.1390525

Field-induced coordinates for the determination of dynamic vibrational nonlinear optical properties

Josep M. Luis
, Miquel Duran
, Bernard Kirtman

Instituto De Química Computacional Y Catálisis

University of California at Santa Barbara

Producción científica: Contribución a una revista › Artículo científico › revisión exhaustiva

48 Citas (Scopus)

Resumen

Three conjugated organic molecules that span a range of polarity and valence-bond/charge transfer characteristics were studied. It was found that dispersion can be insignificant, and that adequate treatment can be achieved with frequency-dependent field-induced vibrational coordinates (FD-FICs).

Idioma original	Inglés
Páginas (desde-hasta)	4473-4483
Número de páginas	11
Publicación	Journal of Chemical Physics
Volumen	115
N.º	10
DOI	https://doi.org/10.1063/1.1390525
Estado	Publicada - 8 sept 2001

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title = "Field-induced coordinates for the determination of dynamic vibrational nonlinear optical properties",

abstract = "Three conjugated organic molecules that span a range of polarity and valence-bond/charge transfer characteristics were studied. It was found that dispersion can be insignificant, and that adequate treatment can be achieved with frequency-dependent field-induced vibrational coordinates (FD-FICs).",

author = "Luis, \{Josep M.\} and Miquel Duran and Bernard Kirtman",

year = "2001",

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doi = "10.1063/1.1390525",

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T1 - Field-induced coordinates for the determination of dynamic vibrational nonlinear optical properties

AU - Luis, Josep M.

AU - Duran, Miquel

AU - Kirtman, Bernard

PY - 2001/9/8

Y1 - 2001/9/8

N2 - Three conjugated organic molecules that span a range of polarity and valence-bond/charge transfer characteristics were studied. It was found that dispersion can be insignificant, and that adequate treatment can be achieved with frequency-dependent field-induced vibrational coordinates (FD-FICs).

AB - Three conjugated organic molecules that span a range of polarity and valence-bond/charge transfer characteristics were studied. It was found that dispersion can be insignificant, and that adequate treatment can be achieved with frequency-dependent field-induced vibrational coordinates (FD-FICs).

UR - https://www.scopus.com/pages/publications/0035828317

U2 - 10.1063/1.1390525

DO - 10.1063/1.1390525

M3 - Scientific article

AN - SCOPUS:0035828317

SN - 0021-9606

VL - 115

SP - 4473

EP - 4483

JO - Journal of Chemical Physics

JF - Journal of Chemical Physics

IS - 10

ER -

Field-induced coordinates for the determination of dynamic vibrational nonlinear optical properties

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