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Physical Chemistry Chemical Physics : PCCP
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June 28, 2019
Complementary first and second derivative methods for ansatz optimization in variational Monte Carlo
Leon Otis, Eric Neuscamman
Journal of Chemical Theory and Computation
|
January 20, 2023
Optimization Stability in Excited-State-Specific Variational Monte Carlo
Leon Otis, Eric Neuscamman
The Journal of Chemical Physics
|
December 23, 2020
A hybrid approach to excited-state-specific variational Monte Carlo and doubly excited states
Leon Otis, Isabel Craig, Eric Neuscamman
Journal of Chemical Theory and Computation
|
December 16, 2025
Noncovalent Interaction Energies with Phaseless Auxiliary-Field Quantum Monte Carlo
Devesh Awasthi, Leon Otis, Emily Huang, et al.
The Journal of Physical Chemistry Letters
|
October 24, 2025
A Scalable Route to First-Order Response Properties with Correlated Sampling Phaseless Auxiliary-Field Quantum Monte Carlo
Leon Otis, Saisrinivas Gudivada, Marvin Friede, et al.
Journal of Chemical Theory and Computation
|
January 9, 2019
Clean and Convenient Tessellations for Number Counting Jastrow Factors
Beatrice W. Van Der Goetz, Leon Otis, Eric Neuscamman
The Journal of Physical Chemistry Letters
|
March 18, 2025
Strongly Correlated States of Transition Metal Spin Defects: The Case of an Iron Impurity in Aluminum Nitride
Leon Otis, Yu Jin, Victor Wen-Zhe Yu, et al.
Journal of the American Chemical Society
|
April 4, 2026
The Curious Case of Dual Emission in 9,10-Bis(phenylethynyl)anthracene
Jakub K Sowa, Colette M Sullivan, Leon Otis, et al.
Chemical Reviews
|
January 2, 2026
Multireference Embedding and Fragmentation Methods for Classical and Quantum Computers: From Model Systems to Realistic Applications
Shreya Verma, Abhishek Mitra, Qiaohong Wang, et al.
Chemical Reviews
|
February 24, 2026
Correction to "Multireference Embedding and Fragmentation Methods for Classical and Quantum Computers: From Model Systems to Realistic Applications"
Shreya Verma, Abhishek Mitra, Qiaohong Wang, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 10) with videos related to
Sort By:
Page
of 1
Physical Chemistry Chemical Physics : PCCP
|
June 28, 2019
Complementary first and second derivative methods for ansatz optimization in variational Monte Carlo
Leon Otis, Eric Neuscamman
Journal of Chemical Theory and Computation
|
January 20, 2023
Optimization Stability in Excited-State-Specific Variational Monte Carlo
Leon Otis, Eric Neuscamman
The Journal of Chemical Physics
|
December 23, 2020
A hybrid approach to excited-state-specific variational Monte Carlo and doubly excited states
Leon Otis, Isabel Craig, Eric Neuscamman
Journal of Chemical Theory and Computation
|
December 16, 2025
Noncovalent Interaction Energies with Phaseless Auxiliary-Field Quantum Monte Carlo
Devesh Awasthi, Leon Otis, Emily Huang, et al.
The Journal of Physical Chemistry Letters
|
October 24, 2025
A Scalable Route to First-Order Response Properties with Correlated Sampling Phaseless Auxiliary-Field Quantum Monte Carlo
Leon Otis, Saisrinivas Gudivada, Marvin Friede, et al.
Journal of Chemical Theory and Computation
|
January 9, 2019
Clean and Convenient Tessellations for Number Counting Jastrow Factors
Beatrice W. Van Der Goetz, Leon Otis, Eric Neuscamman
The Journal of Physical Chemistry Letters
|
March 18, 2025
Strongly Correlated States of Transition Metal Spin Defects: The Case of an Iron Impurity in Aluminum Nitride
Leon Otis, Yu Jin, Victor Wen-Zhe Yu, et al.
Journal of the American Chemical Society
|
April 4, 2026
The Curious Case of Dual Emission in 9,10-Bis(phenylethynyl)anthracene
Jakub K Sowa, Colette M Sullivan, Leon Otis, et al.
Chemical Reviews
|
January 2, 2026
Multireference Embedding and Fragmentation Methods for Classical and Quantum Computers: From Model Systems to Realistic Applications
Shreya Verma, Abhishek Mitra, Qiaohong Wang, et al.
Chemical Reviews
|
February 24, 2026
Correction to "Multireference Embedding and Fragmentation Methods for Classical and Quantum Computers: From Model Systems to Realistic Applications"
Shreya Verma, Abhishek Mitra, Qiaohong Wang, et al.
Page
of 1