Proton-phonon coupling in a hydrogen bonded system

S. F. Fischer; G. L. Hofacker; J. R. Sabin

doi:10.1007/BF02422703

Proton-phonon coupling in a hydrogen bonded system

S. F. Fischer, G. L. Hofacker, J. R. Sabin

Northwestern University

Research output: Contribution to journal › Article › peer-review

13 Scopus citations

Abstract

The Hamiltonian for the dynamics of a structural defect in a linear hydrogen bonded system (e.g., one analogous to an excess proton in ice) is developed, including explicit expressions for the coupling between the defect and phonons. The nature of these couplings are discussed and the results of a minimal basis set SCF calculation on a model system presented. The coupling to the longitudinal phonons is found to be very strong.

Original language	English
Pages (from-to)	268-278
Number of pages	11
Journal	Physik der Kondensierten Materie
Volume	8
Issue number	4
DOIs	https://doi.org/10.1007/BF02422703
State	Published - Feb 1969
Externally published	Yes

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title = "Proton-phonon coupling in a hydrogen bonded system",

abstract = "The Hamiltonian for the dynamics of a structural defect in a linear hydrogen bonded system (e.g., one analogous to an excess proton in ice) is developed, including explicit expressions for the coupling between the defect and phonons. The nature of these couplings are discussed and the results of a minimal basis set SCF calculation on a model system presented. The coupling to the longitudinal phonons is found to be very strong.",

author = "Fischer, {S. F.} and Hofacker, {G. L.} and Sabin, {J. R.}",

year = "1969",

month = feb,

doi = "10.1007/BF02422703",

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pages = "268--278",

journal = "Physik der Kondensierten Materie",

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T1 - Proton-phonon coupling in a hydrogen bonded system

AU - Fischer, S. F.

AU - Hofacker, G. L.

AU - Sabin, J. R.

PY - 1969/2

Y1 - 1969/2

N2 - The Hamiltonian for the dynamics of a structural defect in a linear hydrogen bonded system (e.g., one analogous to an excess proton in ice) is developed, including explicit expressions for the coupling between the defect and phonons. The nature of these couplings are discussed and the results of a minimal basis set SCF calculation on a model system presented. The coupling to the longitudinal phonons is found to be very strong.

AB - The Hamiltonian for the dynamics of a structural defect in a linear hydrogen bonded system (e.g., one analogous to an excess proton in ice) is developed, including explicit expressions for the coupling between the defect and phonons. The nature of these couplings are discussed and the results of a minimal basis set SCF calculation on a model system presented. The coupling to the longitudinal phonons is found to be very strong.

UR - http://www.scopus.com/inward/record.url?scp=34250491031&partnerID=8YFLogxK

U2 - 10.1007/BF02422703

DO - 10.1007/BF02422703

M3 - Article

AN - SCOPUS:34250491031

SN - 0031-9236

VL - 8

SP - 268

EP - 278

JO - Physik der Kondensierten Materie

JF - Physik der Kondensierten Materie

IS - 4

ER -

Proton-phonon coupling in a hydrogen bonded system

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