Crystal structure prediction in the context of inverse materials design
Author:
Publisher
IOP Publishing
Subject
Materials Chemistry,Electrical and Electronic Engineering,Condensed Matter Physics,Electronic, Optical and Magnetic Materials
Link
http://stacks.iop.org/1674-4926/39/i=7/a=071004/pdf
Reference56 articles.
1. The inverse band-structure problem of finding an atomic configuration with given electronic properties
2. Emergence of a few distinct structures from a single formal structure type during high-throughput screening for stable compounds: The case of RbCuS and RbCuSe
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