Supporting data for Rapid Volume Optimisation method


Jackson, A., Skelton, J., Hendon, C., Butler, K., Walsh, A., 2015. Supporting data for Rapid Volume Optimisation method. figshare. https://doi.org/10.6084/m9.figshare.1468388.


Dataset abstract

Supporting data for application of RVO to several systems.

Title: Supporting data for Rapid Volume Optimisation method
Keywords: density functional theory, quantum chemistry, optimisation, CZTS, PbS, PbTe, ZnS, ZnTe, HKUST-1, DFT
Departments: Faculty of Science > Chemistry
DOI: https://doi.org/10.6084/m9.figshare.1468388
URI: https://researchdata.bath.ac.uk/id/eprint/158
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