Différences entre les versions de « CECAM VB NonorCI »

De Workshops
Aller à la navigation Aller à la recherche
Ligne 42 : Ligne 42 :
 
* [http://ics.sorbonne-universites.fr Institut du Calcul et de la Simulation (ICS)]
 
* [http://ics.sorbonne-universites.fr Institut du Calcul et de la Simulation (ICS)]
 
* [http://www.lct.jussieu.fr/ Laboratoire de Chimie Théorique of the UPMC]
 
* [http://www.lct.jussieu.fr/ Laboratoire de Chimie Théorique of the UPMC]
 +
* [http://www.ip2ct.upmc.fr/?lang=fr Institut Parisien de Chimie Physique et Théorique]
  
  

Version du 3 avril 2017 à 12:32

CECAM Workshop on ab initio Valence Bond and Non-Orthogonal CI approaches

27-30 March 2017, Institut Henri Poincarré (IHP), 11, rue Pierre et Marie Curie Paris 75005, Paris


Mulliken-Pauling.JPG

<Mulliken | Pauling > = 0?


Local organizers: Benoît BRAÏDA and Peter REINHARDT

Organizers: Paul W. AYERS, Benoît BRAÏDA, David L COOPER, Peter REINHARDT and Wei WU



Supported by

400px‎ Couleur fond transparent.png Logo lct.png





Motivation (click)


Purposes:

The purpose of this workshop is to bring together leading researchers in the VB and Nonorthogonal-CI communities in order to:

  • share recent advances and new ideas in nonorthogonal orbital-based formalisms, useful approximations to the exact Schrödinger equation, and algorithms or implementations ;
  • to identify and to start to address current challenges and limitations of nonorthogonal and/or VB-related type of approaches.




Practical information and location (click)


Program (click)





25dd5ca7-dd80-4c32-bf87-64374dba7d9d-2060x1236.jpg