Index Catalog // MDR

Description/Abstract:: Scientific simulation codes are public property sustained by the community. Modern technology allows anyone to join scientific software p...
Keyword:: Phonon calculation
Resource Type:: Article
Author:: Atsushi Togo, Laurent Chaput, Terumasa Tadano, and Isao Tanaka
Journal:: JOURNAL OF PHYSICS-CONDENSED MATTER
Date Uploaded:: 08/08/2023

Description/Abstract:: Longitudinal-optical (LO) mode phonon branches of KCl and NaCl were measured using inelastic x-ray scattering (IXS) at 300 K and calculat...
Keyword:: IXS measurment and Phonon calculation
Resource Type:: Article
Author:: Atsushi Togo, Hiroyuki Hayashi, Terumasa Tadano, Satoshi Tsutsui, and Isao Tanaka
Date Uploaded:: 01/02/2023

Description/Abstract:: Discovery of new compounds from wide chemical space is attractive for materials researchers. However, theoretical prediction and validati...
Keyword:: materials search, materials informatics, and density functional theory calculation
Material/Specimen:: nitrides
Resource Type:: Article
Author:: KOYAMA, Yukinori, SEKO, Atsuto, TANAKA, Isao, FUNAHASHI, Shiro, and HIROSAKI, Naoto
Journal:: The Journal of Chemical Physics
Date Uploaded:: 15/06/2021
Date Modified:: 24/06/2022

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