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Materials Chemistry

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particle swarm optimization

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2 results in Keywords: particle swarm optimization

Materials Chemistry

EFFICIENT ORGANIC MOLECULAR CRYSTAL STRUCTURE PREDICTION USING THE DENSITY FUNCTIONAL TIGHT-BINDING METHOD

Maureen Kitheka, Yan Jing, Yan Yao, Puja Goyal

Version 2 posted 01 September 2023

529

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Theoretical and Computational Chemistry

Novel Computational Chemistry Infrastructure for Simulating Astatide in Water: From Basis Sets to Force Fields Using Particle Swarm Optimization

Kennet Espinosa, Alexei Kananenka, Alexander Rusakov

Version 2 posted 17 October 2023

240

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