Module: crystdistrib
Description | Usage |
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Description of module |
Actions
The following actions are part of this module
Name | Description |
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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 |