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资源简介：
JARVIS-DFT
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创建时间：
2020-07-03
相关数据集
Materials Data on Dy2Cu2O5 by Materials Project
Dy2Cu2O5 is Spinel-like structured and crystallizes in the orthorhombic Pna2_1 space group. The structure is three-dimensional. there are two inequivalent Dy3+ sites. In the first Dy3+ site, Dy3+ is b
Mendeley Data2024-01-31 更新50
Neural-network-backed evolutionary search for SrTiO3(110) surface reconstructions
The archive "dataset.tar.gz" contains trained models (neural networks), training-, validation- and test-data and selected structures in POSCAR format, obtained in the neural-network-backed evolutionar
NIAID Data Ecosystem30
Materials Data on Eu2Ga7Ag by Materials Project
Eu2AgGa7 crystallizes in the tetragonal P-4m2 space group. The structure is three-dimensional. Eu is bonded in a 8-coordinate geometry to two equivalent Ag and fourteen Ga atoms. Both Eu–Ag bond lengt
DataCite Commons2021-02-04 更新60
Materials Data on ThAl2Ni3 by Materials Project
ThNi3Al2 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Th is bonded in a 6-coordinate geometry to twelve equivalent Ni and six equivalent Al atoms. All Th–Ni bo
DataCite Commons2021-02-04 更新40
