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Physical Chemistry Chemical Physics : PCCP
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August 22, 2017
Guidelines and diagnostics for charge carrier tuning in thiophene-based wires
Ganna Gryn'ova, Pauline J Ollitrault, Clémence Corminboeuf
Physical Review Letters
|
January 15, 2021
Nonadiabatic Molecular Quantum Dynamics with Quantum Computers
Pauline J Ollitrault, Guglielmo Mazzola, Ivano Tavernelli
Accounts of Chemical Research
|
November 17, 2021
Molecular Quantum Dynamics: A Quantum Computing Perspective
Pauline J Ollitrault, Alexander Miessen, Ivano Tavernelli
Chemical Science
|
September 3, 2020
Hardware efficient quantum algorithms for vibrational structure calculations
Pauline J Ollitrault, Alberto Baiardi, Markus Reiher, et al.
Nature Computational Science
|
January 4, 2024
Quantum algorithms for quantum dynamics
Alexander Miessen, Pauline J Ollitrault, Francesco Tacchino, et al.
Physical Review Letters
|
November 8, 2019
Nonunitary Operations for Ground-State Calculations in Near-Term Quantum Computers
Guglielmo Mazzola, Pauline J Ollitrault, Panagiotis Kl Barkoutsos, et al.
The Journal of Chemical Physics
|
March 23, 2021
Quantum HF/DFT-embedding algorithms for electronic structure calculations: Scaling up to complex molecular systems
Max Rossmannek, Panagiotis Kl Barkoutsos, Pauline J Ollitrault, et al.
Chemical Science
|
June 24, 2021
Quantum algorithm for alchemical optimization in material design
Panagiotis Kl Barkoutsos, Fotios Gkritsis, Pauline J Ollitrault, et al.
Journal of Chemical Theory and Computation
|
April 28, 2025
Molecular Properties from Quantum Krylov Subspace Diagonalization
Oumarou Oumarou, Pauline J Ollitrault, Cristian L Cortes, et al.
Journal of Chemical Theory and Computation
|
June 2, 2021
Improved Accuracy on Noisy Devices by Nonunitary Variational Quantum Eigensolver for Chemistry Applications
Francesco Benfenati, Guglielmo Mazzola, Chiara Capecci, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 15) with videos related to
Sort By:
Page
of 2
Physical Chemistry Chemical Physics : PCCP
|
August 22, 2017
Guidelines and diagnostics for charge carrier tuning in thiophene-based wires
Ganna Gryn'ova, Pauline J Ollitrault, Clémence Corminboeuf
Physical Review Letters
|
January 15, 2021
Nonadiabatic Molecular Quantum Dynamics with Quantum Computers
Pauline J Ollitrault, Guglielmo Mazzola, Ivano Tavernelli
Accounts of Chemical Research
|
November 17, 2021
Molecular Quantum Dynamics: A Quantum Computing Perspective
Pauline J Ollitrault, Alexander Miessen, Ivano Tavernelli
Chemical Science
|
September 3, 2020
Hardware efficient quantum algorithms for vibrational structure calculations
Pauline J Ollitrault, Alberto Baiardi, Markus Reiher, et al.
Nature Computational Science
|
January 4, 2024
Quantum algorithms for quantum dynamics
Alexander Miessen, Pauline J Ollitrault, Francesco Tacchino, et al.
Physical Review Letters
|
November 8, 2019
Nonunitary Operations for Ground-State Calculations in Near-Term Quantum Computers
Guglielmo Mazzola, Pauline J Ollitrault, Panagiotis Kl Barkoutsos, et al.
The Journal of Chemical Physics
|
March 23, 2021
Quantum HF/DFT-embedding algorithms for electronic structure calculations: Scaling up to complex molecular systems
Max Rossmannek, Panagiotis Kl Barkoutsos, Pauline J Ollitrault, et al.
Chemical Science
|
June 24, 2021
Quantum algorithm for alchemical optimization in material design
Panagiotis Kl Barkoutsos, Fotios Gkritsis, Pauline J Ollitrault, et al.
Journal of Chemical Theory and Computation
|
April 28, 2025
Molecular Properties from Quantum Krylov Subspace Diagonalization
Oumarou Oumarou, Pauline J Ollitrault, Cristian L Cortes, et al.
Journal of Chemical Theory and Computation
|
June 2, 2021
Improved Accuracy on Noisy Devices by Nonunitary Variational Quantum Eigensolver for Chemistry Applications
Francesco Benfenati, Guglielmo Mazzola, Chiara Capecci, et al.
Page
of 2