IGMPlot 3.16
Optimized IGMplot version able to use wfn/wfx/xyz files
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Data Structures
Here are the data structures with brief descriptions:
[detail level 12]
 C_ArrayList
 C_KFBlockRun
 C_KFDataBlockHeader32
 C_KFDataBlockHeader64
 C_KFFile
 C_KFIndexBlockEntry32
 C_KFIndexBlockEntry64
 C_KFIndexBlockHeader32
 C_KFIndexBlockHeader64
 C_KFSection
 C_KFSuperIndexBlock32
 C_KFSuperIndexBlock64
 C_KFSuperIndexBlockEntry32
 C_KFSuperIndexBlockEntry64
 C_KFSuperIndexBlockHeader32
 C_KFSuperIndexBlockHeader64
 C_KFVariable
 Caxis_tStructure describing one axis
 Cbond_tStructure describing studied bond (QM treatment)
 CcenterDataStructure to save center data
 CcriticalpointStructure to save critical points
 CLocalDataClass designed to store Gradient related values and provide some utilities concerning those
 CmoleculeOrbitalStructure to save molecule orbital data
 CNCISolverClass designed to manage the entire problem solving concerning the processing of molecular interactions It reads the problem when created and solves it when asked for
 CpointStructure to save 3D point (triplet of doubles)
 CNodeClass used to handle every node data storage and processing ; implemented for multiprocessing implementation ; therefore, thread proof
 Cnorms_tStructure used for the storage of all vectors' norms for the gradients (PROMOL treatment)
 Cparam_tStructure used for the storage of the parameters read from the parameter file param.igm
 Cposition_tStructure describing one 3D position
 Cpositions_tStructure containing a serie of 3D position
 CProgDataClass designed to store the program's main dataprovide some utilities concerning those
 CResultsClass designed to store all results that can be used as output by the program