WMD-group/rvo
Rapid volume optimisation (RVO) tool
A database of electrostatic calculations performed for binary metal oxides from Li2O to PoO2
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Rapid volume optimisation (RVO) tool
First there was POTATO; now we have reconstituted SMASH
A forcefield to describe the structures and properties of metal-organic frameworks
DFT optimised crystal structures of inorganic and hybrid halide perovskites