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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 118, 2020 - Issue 19-20: Special Issue of Molecular Physics in Honour of Jürgen Gauss
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Research Articles

An approximation strategy to compute accurate initial density matrices for repeated self-consistent field calculations at different geometries

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Article: e1779834 | Received 25 Mar 2020, Accepted 03 Jun 2020, Published online: 22 Jun 2020

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