Automated Discovery of Elementary Chemical Reaction Steps Using Freezing String and Berny Optimization Methods�

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TitleAutomated Discovery of Elementary Chemical Reaction Steps Using Freezing String and Berny Optimization Methods�
Publication TypeJournal Article
Year of Publication2015
AuthorsSuleimanov YV, Green WH
JournalJournal of Chemical Theory & Computation
Volume11
Pagination4248
DOI10.1021/acs.jctc.5b00407