Guiding ab initio calculations by alchemical derivatives
- to Baben, M. Institute of Pure and Applied Mathematics, University of California Los Angeles, Los Angeles, California 90095, USA
- Achenbach, J. O. Materials Chemistry, RWTH Aachen University, Kopernikusstr. 10, 52074 Aachen, Germany
- von Lilienfeld, O. A. General Chemistry (ALGC), Free University of Brussels, Pleinlaan 2, 1050 Brussels, Belgium
Published in:
- The Journal of Chemical Physics. - AIP Publishing. - 2016, vol. 144, no. 10, p. 104103
- Language
-
- English
- Open access status
- green
- Identifiers
-
- DOI 10.1063/1.4943372
- ISSN 0021-9606
- Persistent URL
- https://sonar.ch/global/documents/2757
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