Effect of orbital and ionic dynamics coupling in barrier crossing rates for Car-Parrinello molecular dynamics
Chemical Physics Letters
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Main Authors: | , , , |
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Other Authors: | |
Format: | Article |
Published: |
Elsevier
2016
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Online Access: | http://scholarbank.nus.edu.sg/handle/10635/123311 |
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Institution: | National University of Singapore |
Summary: | Chemical Physics Letters |
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