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The Journal of Chemical Physics
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May 10, 2019
Embedding non-collinear two-component electronic structure in a collinear quantum environment
Chad E Hoyer, David B Williams-Young, Chen Huang, et al.
The Journal of Chemical Physics
|
July 16, 2018
State-interaction pair-density functional theory
Andrew M Sand, Chad E Hoyer, Donald G Truhlar, et al.
Small (Weinheim an Der Bergstrasse, Germany)
|
December 19, 2021
Phase-Controlled Synthesis and Quasi-Static Dielectric Resonances in Silver Iron Sulfide (AgFeS<sub>2</sub> ) Nanocrystals
Soohyung Lee, Chad E Hoyer, Can Liao, et al.
Journal of Chemical Theory and Computation
|
September 11, 2024
State Interaction for Relativistic Four-Component Methods: Choose the Right Zeroth-Order Hamiltonian for Late-Row Elements
Chad E Hoyer, Can Liao, Kirill D Shumilov, et al.
The Journal of Chemical Physics
|
September 22, 2014
Diabatization based on the dipole and quadrupole: the DQ method
Chad E Hoyer, Xuefei Xu, Dongxia Ma, et al.
Journal of Chemical Theory and Computation
|
December 5, 2015
Correction to Multiconfiguration Pair-Density Functional Theory Outperforms Kohn-Sham Density Functional Theory and Multireference Perturbation Theory for Ground-State and Excited-State Charge Transfer
Soumen Ghosh, Andrew L Sonnenberger, Chad E Hoyer, et al.
Journal of Chemical Theory and Computation
|
November 18, 2015
Multiconfiguration Pair-Density Functional Theory Outperforms Kohn-Sham Density Functional Theory and Multireference Perturbation Theory for Ground-State and Excited-State Charge Transfer
Soumen Ghosh, Andrew L Sonnenberger, Chad E Hoyer, et al.
The Journal of Chemical Physics
|
February 1, 2023
Correlated Dirac-Coulomb-Breit multiconfigurational self-consistent-field methods
Chad E Hoyer, Lixin Lu, Hang Hu, et al.
Accounts of Chemical Research
|
December 22, 2016
Multiconfiguration Pair-Density Functional Theory: A New Way To Treat Strongly Correlated Systems
Laura Gagliardi, Donald G Truhlar, Giovanni Li Manni, et al.
Journal of Chemical Theory and Computation
|
December 7, 2017
Analytic Gradients for Complete Active Space Pair-Density Functional Theory
Andrew M Sand, Chad E Hoyer, Kamal Sharkas, et al.
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of 3
Search research articles
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Showing results (11-20 of 25) with videos related to
Sort By:
Page
of 3
The Journal of Chemical Physics
|
May 10, 2019
Embedding non-collinear two-component electronic structure in a collinear quantum environment
Chad E Hoyer, David B Williams-Young, Chen Huang, et al.
The Journal of Chemical Physics
|
July 16, 2018
State-interaction pair-density functional theory
Andrew M Sand, Chad E Hoyer, Donald G Truhlar, et al.
Small (Weinheim an Der Bergstrasse, Germany)
|
December 19, 2021
Phase-Controlled Synthesis and Quasi-Static Dielectric Resonances in Silver Iron Sulfide (AgFeS<sub>2</sub> ) Nanocrystals
Soohyung Lee, Chad E Hoyer, Can Liao, et al.
Journal of Chemical Theory and Computation
|
September 11, 2024
State Interaction for Relativistic Four-Component Methods: Choose the Right Zeroth-Order Hamiltonian for Late-Row Elements
Chad E Hoyer, Can Liao, Kirill D Shumilov, et al.
The Journal of Chemical Physics
|
September 22, 2014
Diabatization based on the dipole and quadrupole: the DQ method
Chad E Hoyer, Xuefei Xu, Dongxia Ma, et al.
Journal of Chemical Theory and Computation
|
December 5, 2015
Correction to Multiconfiguration Pair-Density Functional Theory Outperforms Kohn-Sham Density Functional Theory and Multireference Perturbation Theory for Ground-State and Excited-State Charge Transfer
Soumen Ghosh, Andrew L Sonnenberger, Chad E Hoyer, et al.
Journal of Chemical Theory and Computation
|
November 18, 2015
Multiconfiguration Pair-Density Functional Theory Outperforms Kohn-Sham Density Functional Theory and Multireference Perturbation Theory for Ground-State and Excited-State Charge Transfer
Soumen Ghosh, Andrew L Sonnenberger, Chad E Hoyer, et al.
The Journal of Chemical Physics
|
February 1, 2023
Correlated Dirac-Coulomb-Breit multiconfigurational self-consistent-field methods
Chad E Hoyer, Lixin Lu, Hang Hu, et al.
Accounts of Chemical Research
|
December 22, 2016
Multiconfiguration Pair-Density Functional Theory: A New Way To Treat Strongly Correlated Systems
Laura Gagliardi, Donald G Truhlar, Giovanni Li Manni, et al.
Journal of Chemical Theory and Computation
|
December 7, 2017
Analytic Gradients for Complete Active Space Pair-Density Functional Theory
Andrew M Sand, Chad E Hoyer, Kamal Sharkas, et al.
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of 3