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The Journal of Physical Chemistry. B
|
May 16, 2025
Implicit Solvent Sample-Based Quantum Diagonalization
Danil Kaliakin, Akhil Shajan, Fangchun Liang, et al.
The Journal of Chemical Physics
|
April 4, 2024
Prediction challenge: First principles simulation of the ultrafast electron diffraction spectrum of cyclobutanone
Jiří Suchan, Fangchun Liang, Andrew S Durden, et al.
The Journal of Chemical Physics
|
March 9, 2021
CAS without SCF-Why to use CASCI and where to get the orbitals
Benjamin G Levine, Andrew S Durden, Michael P Esch, et al.
Journal of Chemical Theory and Computation
|
June 15, 2026
Quantum-Centric Alchemical Free Energy Calculations
Milana Bazayeva, Zhen Li, Danil Kaliakin, et al.
The Journal of Physical Chemistry. A
|
November 8, 2021
Linear and Nonlinear Optical Processes Controlling S<sub>2</sub> and S<sub>1</sub> Dual Fluorescence in Cyanine Dyes
Maryann Laboe, Jurick Lahiri, Nila Mohan T M, et al.
Journal of Chemical Theory and Computation
|
June 4, 2026
Molecular Quantum Computations on a Protein
Akhil Shajan, Danil Kaliakin, Fangchun Liang, et al.
Communications Physics
|
October 13, 2025
Accurate quantum-centric simulations of intermolecular interactions
Danil Kaliakin, Akhil Shajan, Fangchun Liang, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 7) with videos related to
Sort By:
Page
of 1
The Journal of Physical Chemistry. B
|
May 16, 2025
Implicit Solvent Sample-Based Quantum Diagonalization
Danil Kaliakin, Akhil Shajan, Fangchun Liang, et al.
The Journal of Chemical Physics
|
April 4, 2024
Prediction challenge: First principles simulation of the ultrafast electron diffraction spectrum of cyclobutanone
Jiří Suchan, Fangchun Liang, Andrew S Durden, et al.
The Journal of Chemical Physics
|
March 9, 2021
CAS without SCF-Why to use CASCI and where to get the orbitals
Benjamin G Levine, Andrew S Durden, Michael P Esch, et al.
Journal of Chemical Theory and Computation
|
June 15, 2026
Quantum-Centric Alchemical Free Energy Calculations
Milana Bazayeva, Zhen Li, Danil Kaliakin, et al.
The Journal of Physical Chemistry. A
|
November 8, 2021
Linear and Nonlinear Optical Processes Controlling S<sub>2</sub> and S<sub>1</sub> Dual Fluorescence in Cyanine Dyes
Maryann Laboe, Jurick Lahiri, Nila Mohan T M, et al.
Journal of Chemical Theory and Computation
|
June 4, 2026
Molecular Quantum Computations on a Protein
Akhil Shajan, Danil Kaliakin, Fangchun Liang, et al.
Communications Physics
|
October 13, 2025
Accurate quantum-centric simulations of intermolecular interactions
Danil Kaliakin, Akhil Shajan, Fangchun Liang, et al.
Page
of 1