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Data for "Ground State Absolutely Localized WF-in-DFT Embedding Energies"
Daniel S Graham
(Creator)
Xuelan Wen
(Creator)
Dhabih Chulhai
(Creator)
Jason D Goodpaster
(Creator)
Chemistry (Twin Cities)
Nanoporous Materials Genome Center
Dataset
Overview
Research output
(1)
Research output
Research output per year
2020
2020
2020
1
Article
Research output per year
Research output per year
1 results
Publication Year, Title
(descending)
Publication Year, Title
(ascending)
Title
Type
Filter
Article
Search results
2020
Robust, Accurate, and Efficient: Quantum Embedding Using the Huzinaga Level-Shift Projection Operator for Complex Systems
Graham, D. S., Wen, X.,
Chulhai, D. V.
&
Goodpaster, J. D.
,
Apr 14 2020
,
In:
Journal of Chemical Theory and Computation.
16
,
4
,
p. 2284-2295
12 p.
Research output
:
Contribution to journal
›
Article
›
peer-review
Open Access
Quantum Embedding
100%
Wave Function
100%
Level Shift
100%
Projection Operator
100%
Complex Systems
100%
23
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Scopus citations