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Communications Chemistry
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January 25, 2023
A further step towards the practical application of quantum computing in chemistry
Libor Veis
The Journal of Chemical Physics
|
November 25, 2010
Quantum computing applied to calculations of molecular energies: CH2 benchmark
Libor Veis, Jiří Pittner
The Journal of Chemical Physics
|
June 9, 2014
Adiabatic state preparation study of methylene
Libor Veis, Jiří Pittner
The Journal of Physical Chemistry. A
|
September 10, 2009
Ab initio calculations on the formation and rearrangement of spiropentane
Barry K Carpenter, Jiri Pittner, Libor Veis
The Journal of Physical Chemistry Letters
|
January 17, 2023
Projection-Based Density Matrix Renormalization Group in Density Functional Theory Embedding
Pavel Beran, Katarzyna Pernal, Fabijan Pavošević, et al.
The Journal of Physical Chemistry Letters
|
July 30, 2019
Capturing the Dynamic Correlation for Arbitrary Spin-Symmetry CASSCF Reference with Adiabatic Connection Approaches: Insights into the Electronic Structure of the Tetramethyleneethane Diradical
Ewa Pastorczak, Michał Hapka, Libor Veis, et al.
Journal of Chemical Theory and Computation
|
April 28, 2025
Density Matrix Renormalization Group Approach Based on the Coupled-Cluster Downfolded Hamiltonians
Nicholas Bauman, Libor Veis, Karol Kowalski, et al.
Journal of Chemical Theory and Computation
|
September 27, 2021
Machine Learning-Assisted Selection of Active Spaces for Strongly Correlated Transition Metal Systems
Pavlo Golub, Andrej Antalik, Libor Veis, et al.
The Journal of Physical Chemistry Letters
|
March 24, 2025
Quantum Chemical Density Matrix Renormalization Group Method Boosted by Machine Learning
Pavlo Golub, Chao Yang, Vojtěch Vlček, et al.
The Journal of Physical Chemistry. A
|
January 12, 2024
Variational Quantum Eigensolver Boosted by Adiabatic Connection
Mikuláš Matoušek, Katarzyna Pernal, Fabijan Pavošević, et al.
Page
of 5
Search research articles
Search
Showing results (1-10 of 50) with videos related to
Sort By:
Page
of 5
Communications Chemistry
|
January 25, 2023
A further step towards the practical application of quantum computing in chemistry
Libor Veis
The Journal of Chemical Physics
|
November 25, 2010
Quantum computing applied to calculations of molecular energies: CH2 benchmark
Libor Veis, Jiří Pittner
The Journal of Chemical Physics
|
June 9, 2014
Adiabatic state preparation study of methylene
Libor Veis, Jiří Pittner
The Journal of Physical Chemistry. A
|
September 10, 2009
Ab initio calculations on the formation and rearrangement of spiropentane
Barry K Carpenter, Jiri Pittner, Libor Veis
The Journal of Physical Chemistry Letters
|
January 17, 2023
Projection-Based Density Matrix Renormalization Group in Density Functional Theory Embedding
Pavel Beran, Katarzyna Pernal, Fabijan Pavošević, et al.
The Journal of Physical Chemistry Letters
|
July 30, 2019
Capturing the Dynamic Correlation for Arbitrary Spin-Symmetry CASSCF Reference with Adiabatic Connection Approaches: Insights into the Electronic Structure of the Tetramethyleneethane Diradical
Ewa Pastorczak, Michał Hapka, Libor Veis, et al.
Journal of Chemical Theory and Computation
|
April 28, 2025
Density Matrix Renormalization Group Approach Based on the Coupled-Cluster Downfolded Hamiltonians
Nicholas Bauman, Libor Veis, Karol Kowalski, et al.
Journal of Chemical Theory and Computation
|
September 27, 2021
Machine Learning-Assisted Selection of Active Spaces for Strongly Correlated Transition Metal Systems
Pavlo Golub, Andrej Antalik, Libor Veis, et al.
The Journal of Physical Chemistry Letters
|
March 24, 2025
Quantum Chemical Density Matrix Renormalization Group Method Boosted by Machine Learning
Pavlo Golub, Chao Yang, Vojtěch Vlček, et al.
The Journal of Physical Chemistry. A
|
January 12, 2024
Variational Quantum Eigensolver Boosted by Adiabatic Connection
Mikuláš Matoušek, Katarzyna Pernal, Fabijan Pavošević, et al.
Page
of 5