Researchclopedia

Research Researchers Institutions Topics Submit About

Command Palette

Search for a command to run...

Researchclopedia

Research Researchers Institutions About

© 2026 Researchclopedia. Powered by OpenAlex under CC0 license.

Back to research

CALYPSO: A method for crystal structure prediction

20122,753 citationsJournal Articlegreen Open Access

Authors

Yanchao Wang · Jilin University

Jian Lv · Jilin University

Li Zhu · Jilin University

Yanming Ma · Jilin University

Topics & Keywords

Machine Learning in Materials Science Crystallography and molecular interactions Energetic Materials and Combustion

UN Sustainable Development Goals

Industry, innovation and infrastructure

Publication Details

Published in: Computer Physics Communications

Volume 183, Issue 10, pp. 2063-2070

DOI: 10.1016/j.cpc.2012.05.008

Field-Weighted Citation Impact: 31.02

CALYPSO: A method for crystal structure prediction | Researchclopedia