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Ollitrault, Pauline J.
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1

Nonadiabatic Molecular Dynamics with Fermionic Subspace-Exp..:

Gandon, Anthony ; Baiardi, Alberto ; Ollitrault, Pauline.
Journal of Chemical Theory and Computation.  , 2024
Link: https://doi.org/10.1021/..
 
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2

Reducing the Runtime of Fault-Tolerant Quantum Simulations ..:

Rocca, Dario ; Cortes, Cristian L. ; Gonthier, Jérôme F....
Journal of Chemical Theory and Computation.  20 (2024)  11 - p. 4639-4653 , 2024
Link: https://doi.org/10.1021/..
 
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3

Estimation of Electrostatic Interaction Energies on a Trapp..:

Ollitrault, Pauline J. ; Loipersberger, Matthias ; Parrish, Robert M....
ACS Central Science.  , 2024
Link: https://doi.org/10.1021/..
 
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4

Quantum algorithms for grid-based variational time evolutio:

Ollitrault, Pauline J ; Jandura, Sven ; Miessen, Alexander...
Quantum.  7 (2023)  - p. 1139 , 2023
Link: https://doi.org/10.22331..
 
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5

One-particle Green's functions from the quantum equation of..:

Rizzo, Jacopo ; Libbi, Francesco ; Tacchino, Francesco...
Physical Review Research.  4 (2022)  4 - p. , 2022
Link: https://doi.org/10.1103/..
 
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6

Quantum algorithms for quantum dynamics:

Miessen, Alexander ; Ollitrault, Pauline J. ; Tacchino, Francesco.
Nature Computational Science.  3 (2022)  1 - p. 25-37 , 2022
Link: https://doi.org/10.1038/..
 
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7

Molecular Quantum Dynamics: A Quantum Computing Perspective:

Ollitrault, Pauline J. ; Miessen, Alexander ; Tavernelli, Ivano
Accounts of Chemical Research.  54 (2021)  23 - p. 4229-4238 , 2021
Link: https://doi.org/10.1021/..
 
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8

Improved Accuracy on Noisy Devices by Nonunitary Variationa..:

Benfenati, Francesco ; Mazzola, Guglielmo ; Capecci, Chiara...
Journal of Chemical Theory and Computation.  17 (2021)  7 - p. 3946-3954 , 2021
Link: https://doi.org/10.1021/..
 
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9

Quantum HF/DFT-embedding algorithms for electronic structur..:

Rossmannek, Max ; Barkoutsos, Panagiotis Kl. ; Ollitrault, Pauline J..
The Journal of Chemical Physics.  154 (2021)  11 - p. , 2021
Link: https://doi.org/10.1063/..
 
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10

Quantum algorithm for alchemical optimization in material d..:

Barkoutsos, Panagiotis Kl. ; Gkritsis, Fotios ; Ollitrault, Pauline J....
Chemical Science.  12 (2021)  12 - p. 4345-4352 , 2021
Link: https://doi.org/10.1039/..
 
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11

Quantum algorithms for quantum dynamics: A performance stud..:

Miessen, Alexander ; Ollitrault, Pauline J. ; Tavernelli, Ivano
Physical Review Research.  3 (2021)  4 - p. , 2021
Link: https://doi.org/10.1103/..
 
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12

Hardware efficient quantum algorithms for vibrational struc..:

Ollitrault, Pauline J. ; Baiardi, Alberto ; Reiher, Markus.
Chemical Science.  11 (2020)  26 - p. 6842-6855 , 2020
Link: https://doi.org/10.1039/..
 
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13

Nonadiabatic Molecular Quantum Dynamics with Quantum Comput..:

Ollitrault, Pauline J. ; Mazzola, Guglielmo ; Tavernelli, Ivano
Physical Review Letters.  125 (2020)  26 - p. , 2020
Link: https://doi.org/10.1103/..
 
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14

Quantum equation of motion for computing molecular excitati..:

Ollitrault, Pauline J. ; Kandala, Abhinav ; Chen, Chun-Fu...
Physical Review Research.  2 (2020)  4 - p. , 2020
Link: https://doi.org/10.1103/..
 
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15

Quantum orbital-optimized unitary coupled cluster methods i..:

Sokolov, Igor O. ; Barkoutsos, Panagiotis Kl. ; Ollitrault, Pauline J....
The Journal of Chemical Physics.  152 (2020)  12 - p. , 2020
Link: https://doi.org/10.1063/..
 
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