ModernChargeDensityAnalysis

Software

In our research, we have developed some software:

XD2006 A Computer Program Package for Multipole Refinement, Topological Analysis of Charge Densities and Evaluation of Intermolecular Energies from Experimental and Theoretical Structure Factors
http://www.chem.gla.ac.uk/~louis/xd-home/

PolaBer: A program to compute distributed atomic polarizabilities

 

"Ti accorgerai com'è facile farsi un inutile software di scienza
e vedrai che confuso problema è adoprare la propria esperienza."

(You'll realize how simple is producing a useless science software,
and you'll see how complicated is using one's own experience)

Francesco Guccini, Culodritto

 

Last modified 30.01.2012  Webmaster