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Computational Progress of High Entropy Materials
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Collection: Transport Mechanisms in Energy Materials
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Collection: Machine Learning of Defects in Crystals
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The rule of four: anomalous distributions in the stoichiometries of inorganic compounds
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Representations of molecules and materials for interpolation of quantum-mechanical simulations via machine learning
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Analogical discovery of disordered perovskite oxides by crystal structure information hidden in unsupervised material fingerprints
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Critical assessment of G0W0 calculations for 2D materials: the example of monolayer MoS2