Electronegativity equilibration model for atomic partial charges.

More Information

For more information visit the multicharge website.

Available Versions

These versions of multicharge are available on the BEAR systems (BlueBEAR and BEAR Cloud VMs). These will be retained in accordance with our Applications Support and Retention Policy.

Version BEAR Apps Version
0.2.0-iimkl-2022a 2022a
0.2.0-gfbf-2022b 2022b