Uma biblioteca feita para criar inputs automáticos para o Quantum Espresso, com dados do Materials Project
Project description
ImproveMP
ImproveMP é uma biblioteca pensada para auxiliar pesquisadores na criação de inputs para o software Quantum ESPRESSO, com base no banco de dados ofertado pelo Materials Project (MP).
Instalação
Para instalar a biblioteca, execute o comando abaixo:
pip install ImproveMP
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