The Fourier Grid Hamiltonian method for solving the vibrational Schrödinger equation in internal coordinates: theory and test applications

J Stare; GG Balint-Kurti

doi:10.1021/jp034440z

The Fourier Grid Hamiltonian method for solving the vibrational Schrödinger equation in internal coordinates: theory and test applications

J Stare, GG Balint-Kurti

School of Chemistry

Research output: Contribution to journal › Article (Academic Journal) › peer-review

56 Citations (Scopus)

Translated title of the contribution	The Fourier Grid Hamiltonian method for solving the vibrational Schrödinger equation in internal coordinates: theory and test applications
Original language	English
Pages (from-to)	7204 - 7214
Number of pages	11
Journal	Journal of Physical Chemistry A
Volume	107 (37)
DOIs	https://doi.org/10.1021/jp034440z
Publication status	Published - Sept 2003

Bibliographical note

Publisher: American Chemical Society

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10.1021/jp034440z

http://pubs.acs.org/cgi-bin/abstract.cgi/jpcafh/2003/107/i37/abs/jp034440z.html

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Cite this

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title = "The Fourier Grid Hamiltonian method for solving the vibrational Schr{\"o}dinger equation in internal coordinates: theory and test applications",

author = "J Stare and GG Balint-Kurti",

note = "Publisher: American Chemical Society",

year = "2003",

month = sep,

doi = "10.1021/jp034440z",

language = "English",

volume = "107 (37)",

pages = "7204 -- 7214",

journal = "Journal of Physical Chemistry A",

issn = "1520-5215",

publisher = "American Chemical Society",

}

TY - JOUR

T1 - The Fourier Grid Hamiltonian method for solving the vibrational Schrödinger equation in internal coordinates: theory and test applications

AU - Stare, J

AU - Balint-Kurti, GG

N1 - Publisher: American Chemical Society

PY - 2003/9

Y1 - 2003/9

U2 - 10.1021/jp034440z

DO - 10.1021/jp034440z

M3 - Article (Academic Journal)

SN - 1520-5215

VL - 107 (37)

SP - 7204

EP - 7214

JO - Journal of Physical Chemistry A

JF - Journal of Physical Chemistry A

ER -