Additional Computational data (related to "Functional materials discovery using energy–structure–function maps" manuscript)
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下载链接：
http://eprints.soton.ac.uk/404749
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资源简介：
Dataset supports:
Pulido, Angeles et al. (2017) Functional materials discovery using energy–structure–function maps. Nature.
Computational data related to landscape of predicted crystal structures (*_Predicted_Structures.cif files), energy-structure-function maps (*_ESF_maps.txt and T2_*.txt files) and thermal stability of predicted crystal structures (*_Thermal_Stability_Results.txt) and a master README file related to "Functional materials discovery using energy–structure–function maps" Nature manuscript.
提供机构：
University of Southampton
创建时间：
2017-01-17
