Pressure dependence of the transverse optical mode Grüneisen parameter of crystals

L. Tribe; R. M. Fracchia; J. A.O. Bruno; A. Batana

doi:10.1016/0097-8485(95)00043-R

Pressure dependence of the transverse optical mode Grüneisen parameter of crystals

L. Tribe
, R. M. Fracchia
, J. A.O. Bruno
, A. Batana

Division of Science (Berks)

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

2 Scopus citations

Abstract

A program has been developed to calculate the Grüneisen parameter γ_t = - δ ln ω_t gd ln V for crystals of NaCl, CsCl, CaF₂ and zincblende structures. It allows for the use of different models, various interaction potentials and their parametrizations.

Original language	English (US)
Pages (from-to)	403-408
Number of pages	6
Journal	Computers and Chemistry
Volume	19
Issue number	4
DOIs	https://doi.org/10.1016/0097-8485(95)00043-R
State	Published - Dec 1995

All Science Journal Classification (ASJC) codes

Biotechnology
Applied Microbiology and Biotechnology
General Chemical Engineering

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10.1016/0097-8485(95)00043-R

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@article{fa3cb255162046ed8546e4d1bfccba28,

title = "Pressure dependence of the transverse optical mode Gr{\"u}neisen parameter of crystals",

abstract = "A program has been developed to calculate the Gr{\"u}neisen parameter γt = - δ ln ωt gd ln V for crystals of NaCl, CsCl, CaF2 and zincblende structures. It allows for the use of different models, various interaction potentials and their parametrizations.",

author = "L. Tribe and Fracchia, \{R. M.\} and Bruno, \{J. A.O.\} and A. Batana",

note = "Funding Information: Acknowledgements-Thea uthors gratefully thank Dr T. H. K. Barron for his very helpfulc ommentsa nd discussions. The authors are grateful to the refereesf or their valuablec ommentsw hich have been found very useful for revising the manuscript. We also acknowledge financials upport from Universidadd e BuenosA ires and CONICET; one of us, LT, wishes to acknowledgea CONICET fellowship,d uringw hich part of this work was carriedo ut.",

year = "1995",

month = dec,

doi = "10.1016/0097-8485(95)00043-R",

language = "English (US)",

volume = "19",

pages = "403--408",

journal = "Computers and Chemistry",

issn = "0097-8485",

publisher = "Elsevier Limited",

number = "4",

}

TY - JOUR

T1 - Pressure dependence of the transverse optical mode Grüneisen parameter of crystals

AU - Tribe, L.

AU - Fracchia, R. M.

AU - Bruno, J. A.O.

AU - Batana, A.

N1 - Funding Information: Acknowledgements-Thea uthors gratefully thank Dr T. H. K. Barron for his very helpfulc ommentsa nd discussions. The authors are grateful to the refereesf or their valuablec ommentsw hich have been found very useful for revising the manuscript. We also acknowledge financials upport from Universidadd e BuenosA ires and CONICET; one of us, LT, wishes to acknowledgea CONICET fellowship,d uringw hich part of this work was carriedo ut.

PY - 1995/12

Y1 - 1995/12

N2 - A program has been developed to calculate the Grüneisen parameter γt = - δ ln ωt gd ln V for crystals of NaCl, CsCl, CaF2 and zincblende structures. It allows for the use of different models, various interaction potentials and their parametrizations.

AB - A program has been developed to calculate the Grüneisen parameter γt = - δ ln ωt gd ln V for crystals of NaCl, CsCl, CaF2 and zincblende structures. It allows for the use of different models, various interaction potentials and their parametrizations.

UR - https://www.scopus.com/pages/publications/33644644538

UR - https://www.scopus.com/pages/publications/33644644538#tab=citedBy

U2 - 10.1016/0097-8485(95)00043-R

DO - 10.1016/0097-8485(95)00043-R

M3 - Article

AN - SCOPUS:33644644538

SN - 0097-8485

VL - 19

SP - 403

EP - 408

JO - Computers and Chemistry

JF - Computers and Chemistry

IS - 4

ER -

Pressure dependence of the transverse optical mode Grüneisen parameter of crystals

Abstract

All Science Journal Classification (ASJC) codes

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