Phonon Transport Simulator (PhonTS)
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https://data.mendeley.com/datasets/vn5wph88hy
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资源简介：
This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)
Abstract
Thermal conductivity prediction remains an important subject in many scientific and engineering areas. Only recently has such prediction become possible on the basis of the first principles calculations, thus ensuring high quality results. Implementation of the methodology, however, is technically challenging and requires a lengthy development process. We thus introduce the Phonon Transport Simulator (PhonTS), a Fortran90, fully parallel code to perform such calculations. PhonTS possesses a l...
Title of program: PhonTS
Catalogue Id: AEVO_v1_0
Nature of problem
Computes thermal conductivity in crystal solids from the level of the interatomic interactions.
Versions of this program held in the CPC repository in Mendeley Data
AEVO_v1_0; PhonTS; 10.1016/j.cpc.2015.01.008
AEVO_v1_0; PhonTS; 10.1016/j.cpc.2015.01.008
创建时间：
2018-12-07
