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Pios, Sebastian V.
13  Ergebnisse:
Personensuche X
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1

Artificial-Intelligence-Enhanced On-the-Fly Simulation of N..:

Pios, Sebastian V. ; Gelin, Maxim F. ; Ullah, Arif..
The Journal of Physical Chemistry Letters.  15 (2024)  9 - p. 2325-2331 , 2024
Link: https://doi.org/10.1021/..
 
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2

Accelerating Molecular Vibrational Spectra Simulations with..:

Chen, Yuzhuo ; Pios, Sebastian V. ; Gelin, Maxim F..
Journal of Chemical Theory and Computation.  20 (2024)  11 - p. 4703-4710 , 2024
Link: https://doi.org/10.1021/..
 
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3

MLatom Software Ecosystem for Surface Hopping Dynamics in P..:

Zhang, Lina ; Pios, Sebastian V. ; Martyka, Mikołaj...
Journal of Chemical Theory and Computation.  20 (2024)  12 - p. 5043-5057 , 2024
Link: https://doi.org/10.1021/..
 
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4

AI-enhanced on-the-fly simulation of nonlinear time-resolve..:

Pios, Sebastian V ; Gelin, Maxim F ; Ullah, Arif..
http://arxiv.org/abs/2401.07399.  , 2024
Link: http://arxiv.org/abs/240..
 
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5

Artificial-Intelligence-Enhanced On-the-Fly Simulation of N..:

Sebastian V. Pios ; Maxim F. Gelin ; Arif Ullah..
doi:10.1021/acs.jpclett.4c00107.s001.  , 2024
Link: https://doi.org/10.1021/..
 
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6

Artificial-Intelligence-Enhanced On-the-Fly Simulation of N..:

Sebastian V. Pios ; Maxim F. Gelin ; Arif Ullah..
doi:10.1021/acs.jpclett.4c00107.s001.  , 2024
Link: https://doi.org/10.1021/..
 
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7

Artificial-Intelligence-Enhanced On-the-Fly Simulation of N..:

Sebastian V. Pios ; Maxim F. Gelin ; Arif Ullah..
doi:10.1021/acs.jpclett.4c00107.s002.  , 2024
Link: https://doi.org/10.1021/..
 
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8

Artificial-Intelligence-Enhanced On-the-Fly Simulation of N..:

Sebastian V. Pios ; Maxim F. Gelin ; Arif Ullah..
doi:10.1021/acs.jpclett.4c00107.s002.  , 2024
Link: https://doi.org/10.1021/..
 
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9

Reduction of CO2 with Hydrated Electrons: Ab Initio Computa..:

Pios, Sebastian ; Domcke, Wolfgang
The Journal of Physical Chemistry A.  127 (2023)  15 - p. 3372-3380 , 2023
Link: https://doi.org/10.1021/..
 
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10

Computational Investigations of the Photocatalytic Reductio..:

Pios, Sebastian , 2022
Link: http://nbn-resolving.de/..
 
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11

Ab Initio Electronic Structure Study of the Photoinduced Re..:

Pios, Sebastian ; Domcke, Wolfgang
The Journal of Physical Chemistry A.  126 (2022)  18 - p. 2778-2787 , 2022
Link: https://doi.org/10.1021/..
 
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12

Can Hydrated Electrons be Produced from Water with Visible ..:

Pios, Sebastian ; Huang, Xiang ; Domcke, Wolfgang
ChemPhotoChem.  5 (2021)  7 - p. 680-690 , 2021
Link: https://doi.org/10.1002/..
 
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13

Triangular boron carbon nitrides: an unexplored family of c..:

Pios, Sebastian ; Huang, Xiang ; Sobolewski, Andrzej L..
Physical Chemistry Chemical Physics.  23 (2021)  23 - p. 12968-12975 , 2021
Link: https://doi.org/10.1039/..
 
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