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Keyword
- first principles[remove]2
- ab initio1
- aluminum1
- atomic interaction1
- computational1
- directed assembly1
- high throughput1
- homoepitaxy1
- kinetic monte carlo1
- nudged elastic band1
- quantum mechanical calculation1
- self assembly1
- semiconductor interfaces1
- silicon1
- surface relaxation1
- transition state theory1
- water splitting1