I agree that this site is using cookies. You can find further informations here.
X
Ceriotti, Michele
497  results:
Search for persons X
?
1

Uncertainty quantification by direct propagation of shallow..:

Kellner, Matthias ; Ceriotti, Michele
Machine Learning: Science and Technology.  5 (2024)  3 - p. 035006 , 2024
Link: https://doi.org/10.1088/..
 
?
2

Accelerated chemical science with AI:

Back, Seoin ; Aspuru-Guzik, Alán ; Ceriotti, Michele...
Digital Discovery.  3 (2024)  1 - p. 23-33 , 2024
Link: https://doi.org/10.1039/..
 
?
3

Electronic Excited States from Physically Constrained Machi..:

Cignoni, Edoardo ; Suman, Divya ; Nigam, Jigyasa...
ACS Central Science.  10 (2024)  3 - p. 637-648 , 2024
Link: https://doi.org/10.1021/..
 
?
4

Surface segregation in high-entropy alloys from alchemical ..:

Mazitov, Arslan ; Springer, Maximilian A ; Lopanitsyna, Nataliya...
Journal of Physics: Materials.  7 (2024)  2 - p. 025007 , 2024
Link: https://doi.org/10.1088/..
 
?
5

Mechanism of Charge Transport in Lithium Thiophosphate:

Gigli, Lorenzo ; Tisi, Davide ; Grasselli, Federico.
Chemistry of Materials.  36 (2024)  3 - p. 1482-1496 , 2024
Link: https://doi.org/10.1021/..
 
?
6

Thermal conductivity of Li3PS4 solid electrolytes with ab i..:

Tisi, Davide ; Grasselli, Federico ; Gigli, Lorenzo.
Physical Review Materials.  8 (2024)  6 - p. , 2024
Link: https://doi.org/10.1103/..
 
?
7

scikit-matter : A Suite of Generalisable Machine Learning M..:

Goscinski, Alexander ; Principe, Victor Paul ; Fraux, Guillaume...
Open Research Europe.  3 (2023)  - p. 81 , 2023
Link: https://doi.org/10.12688..
 
?
8

Fast evaluation of spherical harmonics with sphericart:

Bigi, Filippo ; Fraux, Guillaume ; Browning, Nicholas J..
The Journal of Chemical Physics.  159 (2023)  6 - p. , 2023
Link: https://doi.org/10.1063/..
 
?
9

2021 JCP Emerging Investigator Special Collection:

Ceriotti, Michele ; Jensen, Lasse ; Manolopoulos, David E....
The Journal of Chemical Physics.  158 (2023)  6 - p. , 2023
Link: https://doi.org/10.1063/..
 
?
10

A data-driven interpretation of the stability of organic mo..:

Cersonsky, Rose K. ; Pakhnova, Maria ; Engel, Edgar A..
Chemical Science.  14 (2023)  5 - p. 1272-1285 , 2023
Link: https://doi.org/10.1039/..
 
?
11

Modeling high-entropy transition metal alloys with alchemic..:

Lopanitsyna, Nataliya ; Fraux, Guillaume ; Springer, Maximilian A...
Physical Review Materials.  7 (2023)  4 - p. , 2023
Link: https://doi.org/10.1103/..
 
?
12

Robustness of Local Predictions in Atomistic Machine Learni..:

Chong, Sanggyu ; Grasselli, Federico ; Ben Mahmoud, Chiheb...
Journal of Chemical Theory and Computation.  19 (2023)  22 - p. 8020-8031 , 2023
Link: https://doi.org/10.1021/..
 
?
13

scikit-matter : A Suite of Generalisable Machine Learning M..:

Goscinski, Alexander ; Principe, Victor Paul ; Fraux, Guillaume...
Open Research Europe.  3 (2023)  - p. 81 , 2023
Link: https://doi.org/10.12688..
 
?
14

Physics-Inspired Equivariant Descriptors of Nonbonded Inter..:

Huguenin-Dumittan, Kevin K. ; Loche, Philip ; Haoran, Ni.
The Journal of Physical Chemistry Letters.  14 (2023)  43 - p. 9612-9618 , 2023
Link: https://doi.org/10.1021/..
 
?
15

Machine learning the thermodynamic stability of crystal str..:

Schmidt, Jonathan , [2022?]
Link: http://nbn-resolving.de/..
 
1-15