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Filtering by: License https://creativecommons.org/licenses/by/4.0/ Type of work Dataset Rights Statement Sim Creative Commons BY Attribution 4.0 International

Leveraging Segmentation of Physical Units through a Newly Open Source Corpus

Description/Abstract:

The identification of physical measurements is a recurrent need in materials informatics (MI). For example, the extraction of superconduc...

Resource Type:

Dataset

Data origin:

informatics and data science

Author:

FOPPIANO, Luca, TANIFUJI, Mikiko, ISHII, Masashi, DIEB M. Thear, and SUZUKI, Akira

Date Uploaded:

25/10/2019

Date Modified:

15/06/2020
Liquid electrolyte informatics using an exhaustive search with linear regression

Description/Abstract:

Exploring new liquid electrolyte materials is a fundamental target for developing new high-performance lithium-ion batteries. In contrast...

Keyword:

Gaussian09, Li-ion battery, materials informatics, molecules, organic solvents, and quantum chemistry calculations

Material/Specimen:

organic solvents

Resource Type:

Dataset

Data origin:

simulations

Author:

SODEYAMA, Keitaro, IGARASHI, Yasuhiko, NAKAYAMA, Tomofumi, TATEYAMA, Yoshitaka, and OKADA, Masato

Journal:

Physical Chemistry Chemical Physics

Date Uploaded:

09/09/2020

Date Modified:

30/06/2021
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