Dice Fortran Backend Documentation
netcdf_out.f90 File Reference

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Modules

module  write_netcdf
 Contains NetCDF output functions for different problem main & equilibration runs.
 

Functions/Subroutines

subroutine write_netcdf::error_check (ierr)
 Checks error status at each point of NetCDF file build. More...
 
subroutine write_netcdf::write_qho_equilibration (position_array, energy_array, filename, ierr, QHO, accept_rate, alpha)
 Output QHO system traces for equilibration. More...
 
subroutine write_netcdf::write_h2plus_equilibration (position_array, energy_array, filename, ierr, H2plus, accept_rate, c, bond_length)
 Output H2_plus system trace for equilibration. More...
 
subroutine write_netcdf::write_h2_equilibration (position_array, energy_array, filename, ierr, H2, accept_rate, beta, bond_length)
 Output H2 system trace for equilibration. More...
 
subroutine write_netcdf::write_qho_main (alpha_array, energy_array, uncertainty_array, filename, ierr, QHO, accept_rate)
 Output results of QHO MCMC run. More...
 
subroutine write_netcdf::write_h2plus_main (param_array, bondlength_array, energy_array, uncertainty_array, filename, ierr, H2plus, accept_rate)
 Output results of H2plus MCMC run. More...
 
subroutine write_netcdf::write_h2_main (param_a_array, param_beta_array, bondlength_array, energy_array, uncertainty_array, filename, ierr, H2, accept_rate)
 Output results of H2 MCMC run. More...
 
subroutine write_netcdf::chain_output_1d (position_array, energy_array, filename, ierr)
 Output 1d position and energy arrays of MCMC run to NetCDF file [UNUSED]. More...
 
subroutine write_netcdf::chain_output_3d (position_array_3d, energy_array, filename, ierr)
 Output 3d position and 1d energy arrays of MCMC run to NetCDF file [UNUSED]. More...
 
subroutine write_netcdf::append_to_array (array, filename, ierr)
 Appends array to a 1d NetCDF array in file [UNUSED]. More...