A genetic algorithm based inverse band structure method for semiconductor alloys

DOI10.1016/j.jcp.2005.03.005zbMath1074.82549OpenAlexW1967157694MaRDI QIDQ2485711

Wesley B. Jones, Kwiseon Kim, Peter A. Graf

Publication date: 5 August 2005

Published in: Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/j.jcp.2005.03.005

zbMATH Keywords

Genetic algorithmsOptimizationInverse problemMaterial designElectronic structurePseudopotentials

Mathematics Subject Classification ID

Statistical mechanics of semiconductors (82D37) Genetics and epigenetics (92D10)

Related Items (4)

Surface passivation optimization using DIRECT ⋮ MDTri: robust and efficient global mixed integer search of spaces of multiple ternary alloys. A DIRECT-inspired optimization algorithm for experimentally accessible computational material design ⋮ A projection based multiscale optimization method for eigenvalue problems ⋮ A note on the virtual crystal approach to alloy optimization

Uses Software

• ASA
• PGAPack

Cites Work

• Scatter search. Methodology and implementation in C. With CD-ROM.
• Parallel empirical pseudopotential electronic structure calculations for million atom systems
• Introduction to evolutionary computing
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