CompBV

is a program system developed for the computation of bond valence parameters and the analysis of optimization results. It uses data from the ICSD for the determination of parameters and allows the user to influence computation by setting filters and by choosing different optimization algorithms (simulated annealing, general reduced gradient method, fixed grid minimum, environment search).

A short description of the system can be found here

CompBV is no more available online. However, in a list of bond valence parameters you find values computed with the system and compared to parameters published elsewhere.

For any comments or questions concerning the system feel free to contact
hans-joachimklein@t-online.de