Materials Science · Physics
Global optimization in the discrete and variable-dimension conformational space: The case of crystal with the strongest atomic cohesion
Guanjian Cheng, Xin-Gao Gong, Wan-Jian Yin
2025-03-03
Mesoscale and Nanoscale Physics · Physics
Quantitative Chemistry and the Discrete Geometry of Conformal Atom-Thin Crystals
Alejandro A. Pacheco Sanjuan, Mehrshad Mehboudi, Edmund O. Harriss, Humberto Terrones +1
2014-02-27
Computational Geometry · Computer Science
Optimizing micro-tiles in micro-structures as a design paradigm
Pablo Antolin, Annalisa Buffa, Elaine Cohen, John F. Dannenhoffer +4
2019-07-05
Materials Science · Physics
Method for determining optimal supercell representation of interfaces
Daniele Stradi, Line Jelver, Søren Smidstrup, Kurt Stokbro
2017-04-26
Materials Science · Physics
Contact Map based Crystal Structure Prediction using Global Optimization
Jianjun Hu, Wenhui Yang, Rongzhi Dong, Yuxin Li +2
2021-02-09
Materials Science · Physics
Crystal structure prediction of materials with high symmetry using differential evolution
Wenhui Yang, Edirisuriya M. Dilanga Siriwardane, Rongzhi Dong, Yuxin Li +1
2021-09-22
Materials Science · Physics
Lead germanate: an advanced material for infrared electro-optic modulators
N. Demyanyshyn, B. Mytsyk, O. Buryy, A. Andrushchak
2024-10-10
Neural and Evolutionary Computing · Computer Science
Multi-Objective Quality-Diversity for Crystal Structure Prediction
Hannah Janmohamed, Marta Wolinska, Shikha Surana, Thomas Pierrot +2
2024-06-24