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Projects/Programs: mgi

Displaying 1 - 25 of 45

Automation for Atomistic Simulation

As part of NIST's response to the Materials Genome Initiative (MGI), this project addresses the need for automation for the assembly and distribution of

CALPHAD Data Informatics

The Materials Genome Initiative (MGI) creates a new era of materials innovation that will serve as a foundation for strengthening domestic industries in these

CHiMaD Phase Field Community

CHiMaD Phase Field Website Repository See the live website at pages.nist.gov/chimad-phase-field. In January 2015 a group of phase field

Cloud of Reproducible Records

An important part of the NIST (National Institute of Science and Technology) MGI (Materials Genome Initiative) effort is to investigate infrastructure and tools

DFT Benchmarking

DFT is a widely used computational technique in the material science community and it provides interpretative tools for understanding experimental results as

JARVIS-DFT

JARVIS-DFT is a density functional theory calculation database for 2D materials, solar cells and thermoelectrics. At present, the database consists of 873 DFT

JARVIS-FF

JARVIS-FF: Evaluation and comparison of classical interatomic potentials JARVIS-FF is a database designed to help Molecular Dynamics and/or Monte Carlo users

Materials Data Repository

The NIST Materials Data Repository is open to the research community interested in developing best practices in the management of materials data. We are

Materials Design Toolkit

This framework provides the generic environment for materials design. The ICME (Integrating Computational Materials Engineering) approach is implemented for

MGI Code Catalog

The MGI Code Catalog represents an extensive collection of information about software relevant to computational materials science and materials data analysis