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资源简介:
JARVIS-DFT
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创建时间:
2020-07-17
相关数据集
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Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For
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Quantum Point Defects in 2D Materials (QPOD) Database
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Morphology of Fluids Confined in Physically Reconstructed Mesoporous Silica: Experiment and Mean Field Density Functional Theory
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Materials Data on TaCo2N3 by Materials Project
Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For
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Materials Data on Li2Mn3NiO8 by Materials Project
Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For
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