NEIGHCRYS

A utility program for setting up input files for DMACRYS, which models crystals of rigid organic molecules using anisotropic atom-atom intermolecular potentials, of the type defined in the book “The Theory of Intermolecular Forces” by AJ Stone (Oxford University Press, 2013 2nd edition).

More Information

For more information visit the NEIGHCRYS website.

Available Versions

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