MPI-SCATCI
2.0
An MPI version of SCATCI
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Output from diagonalization. More...
Public Member Functions | |
procedure(handle_eigenvalues), deferred, public | handle_eigenvalues |
procedure(handle_eigenvector), deferred, public | handle_eigenvector |
procedure(export_eigenvalues), deferred, public | export_eigenvalues |
Private Member Functions | |
procedure | export_header |
procedure | write_header |
procedure | finalize_solutions |
Private Attributes | |
type(civect) | ci_vec |
Data structure for keeping the solution of the eigensystem. More... | |
integer | vector_storage = SAVE_CONTINUUM_COEFFS |
integer | continuum_dimen |
Output from diagonalization.
Base class for SolutionHandler_module::SolutionHandler and Target_RMat_CI_module::Target_RMat_CI. Can be used as a storage for the eigensolution when that is to be passed to CDENPROP.
Definition at line 48 of file DiagonalizerResult_module.f90.
procedure(export_eigenvalues), deferred, public diagonalizerresult_module::diagonalizerresult::export_eigenvalues |
Definition at line 56 of file DiagonalizerResult_module.f90.
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Definition at line 57 of file DiagonalizerResult_module.f90.
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Definition at line 59 of file DiagonalizerResult_module.f90.
procedure(handle_eigenvalues), deferred, public diagonalizerresult_module::diagonalizerresult::handle_eigenvalues |
Definition at line 54 of file DiagonalizerResult_module.f90.
procedure(handle_eigenvector), deferred, public diagonalizerresult_module::diagonalizerresult::handle_eigenvector |
Definition at line 55 of file DiagonalizerResult_module.f90.
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Definition at line 58 of file DiagonalizerResult_module.f90.
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Data structure for keeping the solution of the eigensystem.
Definition at line 49 of file DiagonalizerResult_module.f90.
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Definition at line 52 of file DiagonalizerResult_module.f90.
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Definition at line 51 of file DiagonalizerResult_module.f90.