23 August 2022
-
27 August 2022
Palais des Congrès de Versailles
Home
Back to ECM website
Software development in quantum mechanics-based methods of crystallography
24 August 2022
5
,
Live
•
MS36
•
14:00
>
16:00
•
Software development in quantum mechanics-based methods of crystallography
•
Boileau
14:00
•
460
•
The multipolar model: still alive!
>
P.
Piero
MACCHI
14:30
•
79
•
Neural network predictors in Quantum Chemical Topology
>
Á.
Ángel
MARTÍN PENDÁS
15:00
•
293
•
DiSCaMB - a package for computations with aspherical atom form factors (HAR, TAAM).
>
M.
Michał
CHODKIEWICZ
15:20
•
498
•
A Periodic Density Source for a Periodic System: Using PAW-DFT for Hirshfeld Atom Refinement in XHARPy
>
P.
Paul Niklas
RUTH
15:40
•
85
•
MATTS2021 data bank: application of cluster analysis to interpret electron density of atom types
>
P.
Paulina Maria
RYBICKA
Copyright © key4events - All rights reserved