Benchmark of Excitation Energy Shifts from Frozen-Density Embedding Theory: Introduction of a Density-Overlap-Based Applicability Threshold
Published inJournal of Chemical Theory and Computation, vol. 14, no. 8, p. 4028-4040
Publication date2018
Abstract
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ZECH, Alexander et al. Benchmark of Excitation Energy Shifts from Frozen-Density Embedding Theory: Introduction of a Density-Overlap-Based Applicability Threshold. In: Journal of Chemical Theory and Computation, 2018, vol. 14, n° 8, p. 4028–4040. doi: 10.1021/acs.jctc.8b00201
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- PID : unige:140854
- DOI : 10.1021/acs.jctc.8b00201
Additional URL for this publicationhttps://pubs.acs.org/doi/10.1021/acs.jctc.8b00201
Journal ISSN1549-9618
