Journal
JOURNAL OF CHEMICAL PHYSICS
Volume 142, Issue 22, Pages -Publisher
AIP Publishing
DOI: 10.1063/1.4922295
Keywords
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Funding
- Villum foundation
- ETH Zurich
- Schweizer Nationalfonds (SNF) [200021L_156598]
- Danish Council for Independent Research \ Natural Sciences [12-127074]
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We present a new hybrid multiconfigurational method based on the concept of range-separation that combines the density matrix renormalization group approach with density functional theory. This new method is designed for the simultaneous description of dynamical and static electroncorrelation effects in multiconfigurational electronic structure problems. (C) 2015 AIP Publishing LLC.
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