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mispr

MISPR: Materials Informatics for Structure-Property Relationships

Rasha Atwi, Matthew Bliss, Maxim Makeev, and Nav Nidhi Rajput

Stony Brook University

Table of Contents

Introduction

MISPR is a software that executes, manages, and stores computational materials science simulations. It contains pre-defined DFT and MD workflows to calculate and analyze different properties of materials.

Installation

Requirements

Usage

Citation

If you find MISPR useful in your research, please consider citing the following paper.

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