Module: crystdistrib

Description Usage
Description of module used in 0 tutorialsused in 0 eggs

Actions

The following actions are part of this module

Name Description
BOPS Calculate the BOPS order parameter
DOPS Calculate the DOPS order parameter
QUATERNION Calculate quaternions for molecules.
QUATERNION_BOND_PRODUCT_MATRIX Calculate the product between a matrix of quaternions and the bonds
QUATERNION_PRODUCT_MATRIX Calculate the outer product matrix from two vectors of quaternions
ROPS Calculate the ROPS order parameter