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(git:92574dc)
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(git:92574dc)
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module analyses element of the TMC tree element structure e.g. density, radial distribution function, dipole correlation,... More...
Functions/Subroutines | |
| subroutine, public | tmc_read_ana_input (tmc_ana_section, tmc_ana) |
| creates a new para environment for tmc analysis | |
| subroutine, public | analysis_init (ana_env, nr_dim) |
| initialize all the necessarry analysis structures | |
| subroutine, public | analysis_restart_print (ana_env) |
| print analysis restart file | |
| subroutine, public | analysis_restart_read (ana_env, elem) |
| read analysis restart file | |
| subroutine, public | do_tmc_analysis (elem, ana_env) |
| call all the necessarry analysis routines analysis the previous element with the weight of the different configuration numbers and stores the actual in the structur % last_elem afterwards the previous configuration can be deallocated (outside) | |
| subroutine, public | finalize_tmc_analysis (ana_env) |
| call all the necessarry analysis printing routines | |
| subroutine, public | analyze_file_configurations (start_id, end_id, dir_ind, ana_env, tmc_params) |
| read the files and analyze the configurations | |
module analyses element of the TMC tree element structure e.g. density, radial distribution function, dipole correlation,...
| subroutine, public tmc_analysis::tmc_read_ana_input | ( | type(section_vals_type), pointer | tmc_ana_section, |
| type(tmc_analysis_env), pointer | tmc_ana ) |
creates a new para environment for tmc analysis
| tmc_ana_section | ... |
| tmc_ana | TMC analysis environment |
Definition at line 85 of file tmc_analysis.F.
| subroutine, public tmc_analysis::analysis_init | ( | type(tmc_analysis_env), pointer | ana_env, |
| integer | nr_dim ) |
initialize all the necessarry analysis structures
| ana_env | ... |
| nr_dim | dimension of the pos, frc etc. array |
Definition at line 205 of file tmc_analysis.F.
| subroutine, public tmc_analysis::analysis_restart_print | ( | type(tmc_analysis_env), pointer | ana_env | ) |
print analysis restart file
| ana_env | ... |
author Mandes 02.2013
Definition at line 272 of file tmc_analysis.F.
| subroutine, public tmc_analysis::analysis_restart_read | ( | type(tmc_analysis_env), pointer | ana_env, |
| type(tree_type), pointer | elem ) |
read analysis restart file
| ana_env | ... |
| elem | ... |
author Mandes 02.2013
Definition at line 369 of file tmc_analysis.F.
| subroutine, public tmc_analysis::do_tmc_analysis | ( | type(tree_type), pointer | elem, |
| type(tmc_analysis_env), pointer | ana_env ) |
call all the necessarry analysis routines analysis the previous element with the weight of the different configuration numbers and stores the actual in the structur % last_elem afterwards the previous configuration can be deallocated (outside)
| elem | ... |
| ana_env | ... |
author Mandes 02.2013
Definition at line 468 of file tmc_analysis.F.
| subroutine, public tmc_analysis::finalize_tmc_analysis | ( | type(tmc_analysis_env), pointer | ana_env | ) |
call all the necessarry analysis printing routines
| ana_env | ... |
author Mandes 02.2013
Definition at line 606 of file tmc_analysis.F.
| subroutine, public tmc_analysis::analyze_file_configurations | ( | integer | start_id, |
| integer | end_id, | ||
| integer, optional | dir_ind, | ||
| type(tmc_analysis_env), pointer | ana_env, | ||
| type(tmc_param_type), pointer | tmc_params ) |
read the files and analyze the configurations
| start_id | ... |
| end_id | ... |
| dir_ind | ... |
| ana_env | ... |
| tmc_params | ... |
Definition at line 656 of file tmc_analysis.F.
1.15.0