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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

On the basis set selection for calculations of core-level states: different strategies to balance cost and accuracy

Ronit Sarangia Department of Chemistry, University of Southern California, Los Angeles, CA, USAORCID Iconhttps://orcid.org/0000-0002-5838-003XView further author information
ORCID Icon,
Marta L. Vidalb DTU Chemistry – Department of Chemistry, Technical University of Denmark, Lyngby, DenmarkORCID Iconhttps://orcid.org/0000-0003-0653-2078View further author information
ORCID Icon,
Sonia Corianib DTU Chemistry – Department of Chemistry, Technical University of Denmark, Lyngby, DenmarkORCID Iconhttps://orcid.org/0000-0002-4487-897XView further author information
ORCID Icon &
Anna I. Krylova Department of Chemistry, University of Southern California, Los Angeles, CA, USACorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0001-6788-5016View further author information
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Article: e1769872 | Received 03 Apr 2020, Accepted 08 May 2020, Published online: 28 May 2020

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