Ich stimme zu, dass diese Seite Cookies verwende. Weitere Informationen finden Sie unter unseren Datenschutzerklärungen .
X
Kapil, Venkat
66  Ergebnisse:
Personensuche X
?
1

Electrified/charged aqueous interfaces: general discussion:

Advincula, Xavier R. ; Backus, Ellen H. G. ; Bonn, Mischa...
Faraday Discussions.  249 (2024)  - p. 381-407 , 2024
Link: https://doi.org/10.1039/..
 
?
2

Ice interfaces: general discussion:

Advincula, Xavier R. ; Backus, Ellen H. G. ; Bartels-Rausch, Thorsten...
Faraday Discussions.  249 (2024)  - p. 133-161 , 2024
Link: https://doi.org/10.1039/..
 
?
3

First-principles spectroscopy of aqueous interfaces using m..:

Kapil, Venkat ; Kovács, Dávid Péter ; Csányi, Gábor.
Faraday Discussions.  249 (2024)  - p. 50-68 , 2024
Link: https://doi.org/10.1039/..
 
?
4

Dynamics and nano-rheology of interfacial water: general di..:

Advincula, Xavier R. ; Blow, Katarina E. ; Bonn, Mischa...
Faraday Discussions.  249 (2024)  - p. 243-266 , 2024
Link: https://doi.org/10.1039/..
 
?
5

Many-Body Methods for Surface Chemistry Come of Age: Achiev..:

Shi, Benjamin X. ; Zen, Andrea ; Kapil, Venkat...
Journal of the American Chemical Society.  145 (2023)  46 - p. 25372-25381 , 2023
Link: https://doi.org/10.1021/..
 
?
6

A complete description of thermodynamic stabilities of mole..:

Kapil, Venkat ; Engel, Edgar A.
Proceedings of the National Academy of Sciences.  119 (2022)  6 - p. , 2022
Link: https://doi.org/10.1073/..
 
?
7

Quantum dynamics using path integral coarse-graining:

Musil, Félix ; Zaporozhets, Iryna ; Noé, Frank..
The Journal of Chemical Physics.  157 (2022)  18 - p. , 2022
Link: https://doi.org/10.1063/..
 
?
8

The first-principles phase diagram of monolayer nanoconfine..:

Kapil, Venkat ; Schran, Christoph ; Zen, Andrea...
Nature.  609 (2022)  7927 - p. 512-516 , 2022
Link: https://doi.org/10.1038/..
 
?
9

General embedded cluster protocol for accurate modeling of ..:

Shi, Benjamin X. ; Kapil, Venkat ; Zen, Andrea...
The Journal of Chemical Physics.  156 (2022)  12 - p. , 2022
Link: https://doi.org/10.1063/..
 
?
10

Simulating the ghost: quantum dynamics of the solvated elec..:

Lan, Jinggang ; Kapil, Venkat ; Gasparotto, Piero...
Nature Communications.  12 (2021)  1 - p. , 2021
Link: https://doi.org/10.1038/..
 
?
11

Importance of Nuclear Quantum Effects for NMR Crystallograp..:

Engel, Edgar A. ; Kapil, Venkat ; Ceriotti, Michele
The Journal of Physical Chemistry Letters.  12 (2021)  32 - p. 7701-7707 , 2021
Link: https://doi.org/10.1021/..
 
?
12

Uncertainty estimation for molecular dynamics and sampling:

Imbalzano, Giulio ; Zhuang, Yongbin ; Kapil, Venkat...
The Journal of Chemical Physics.  154 (2021)  7 - p. , 2021
Link: https://doi.org/10.1063/..
 
?
13

Efficient Quantum Vibrational Spectroscopy of Water with Hi..:

Shepherd, Sam ; Lan, Jinggang ; Wilkins, David M..
The Journal of Physical Chemistry Letters.  12 (2021)  37 - p. 9108-9114 , 2021
Link: https://doi.org/10.1021/..
 
?
14

Author Correction: Simulating the ghost: quantum dynamics o..:

Lan, Jinggang ; Kapil, Venkat ; Gasparotto, Piero...
Nature Communications.  12 (2021)  1 - p. , 2021
Link: https://doi.org/10.1038/..
 
?
15

Accurate Description of Nuclear Quantum Effects with High-O..:

Poltavsky, Igor ; Kapil, Venkat ; Ceriotti, Michele..
Journal of Chemical Theory and Computation.  16 (2020)  2 - p. 1128-1135 , 2020
Link: https://doi.org/10.1021/..
 
1-15