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The Journal of Chemical Physics
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February 9, 2022
Huzinaga projection embedding for efficient and accurate energies of systems with localized spin-densities
Daniel S Graham, Xuelan Wen, Dhabih V Chulhai, et al.
Journal of Chemical Theory and Computation
|
February 28, 2020
Robust, Accurate, and Efficient: Quantum Embedding Using the Huzinaga Level-Shift Projection Operator for Complex Systems
Daniel S Graham, Xuelan Wen, Dhabih V Chulhai, et al.
Journal of Chemical Theory and Computation
|
November 27, 2019
Absolutely Localized Projection-Based Embedding for Excited States
Xuelan Wen, Daniel S Graham, Dhabih V Chulhai, et al.
Journal of Chemical Theory and Computation
|
August 27, 2019
Fully Quantum Embedding with Density Functional Theory for Full Configuration Interaction Quantum Monte Carlo
Hayley R Petras, Daniel S Graham, Sai Kumar Ramadugu, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 4) with videos related to
Sort By:
Page
of 1
The Journal of Chemical Physics
|
February 9, 2022
Huzinaga projection embedding for efficient and accurate energies of systems with localized spin-densities
Daniel S Graham, Xuelan Wen, Dhabih V Chulhai, et al.
Journal of Chemical Theory and Computation
|
February 28, 2020
Robust, Accurate, and Efficient: Quantum Embedding Using the Huzinaga Level-Shift Projection Operator for Complex Systems
Daniel S Graham, Xuelan Wen, Dhabih V Chulhai, et al.
Journal of Chemical Theory and Computation
|
November 27, 2019
Absolutely Localized Projection-Based Embedding for Excited States
Xuelan Wen, Daniel S Graham, Dhabih V Chulhai, et al.
Journal of Chemical Theory and Computation
|
August 27, 2019
Fully Quantum Embedding with Density Functional Theory for Full Configuration Interaction Quantum Monte Carlo
Hayley R Petras, Daniel S Graham, Sai Kumar Ramadugu, et al.
Page
of 1