CompBV

is an interactive program system 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


Currently, the system is not available online. You can find, however, a list of bond valence parameters computed with CompBV which is compared to parameters published elsewhere here