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Filtering by: License https://creativecommons.org/licenses/by/4.0/ Keyword First-principles calculation Keyword quasi-harmonic vibrational contribution Keyword Debye model

1. Examples of SQS (special quasirandom structure) models for arbitrary binary bcc (body centered cubic) and hcp (hexagonal close packed) structures

Description/Abstract:: These atomic coordinates are examples of SQS (special quasirandom structure) models for arbitrary binary bcc (body centered cubic) and hc...
Keyword:: Debye model, First-principles calculation, Sommerfeld model, quasi-harmonic vibrational contribution, and titanium alloys
Resource Type:: Dataset
Data origin:: simulations
Author:: SAHARA, Ryoji
Date Uploaded:: 09/10/2020
Date Modified:: 20/10/2020

1. Examples of SQS (special quasirandom structure) models for arbitrary binary bcc (body centered cubic) and hcp (hexagonal close packed) structures

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1. Examples of SQS (special quasirandom structure) models for arbitrary binary bcc (body centered cubic) and hcp (hexagonal close packed) structures

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