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Abstract
Analytic gradients for the partially renormalized second-order Moller-Plesset perturbation theory (Scheme I) are derived using the Lagrangian method. This is just a technical document and is not intended for publication.
Analytic Gradients for PR-MP2 (Scheme I)
26 October 2023, Version 1
Working Paper
Authors
This content is a preprint and has not undergone peer review at the time of posting.
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Version History
Oct 26, 2023 Version 1
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Funding
Japan Society for the Promotion of Science
Author’s competing interest statement
The author(s) have declared they have no conflict of interest with regard
to this content
Ethics
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