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Divya Sharma

1PUBLICATIONS

2CO-AUTHORS

Theoretical quantum chemistry

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Publications (1)

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|Apr 07, 2022

Protocol for Directing Nudged Elastic Band Calculations to the Minimum Energy Pathway: Nurturing Errant Calculations Back to Convergence.

Andrew W Ruttinger, Divya Sharma, Paulette Clancy

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Andrew W Ruttinger

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Paulette Clancy

Frequent Collaborators

1 joint publications

Andrew W Ruttinger

1 joint publications

Paulette Clancy

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