viperleed.calc.sections.refcalc

Section Reference Calculation.

Functions

compile_refcalc(comptask)	Function meant to be executed by parallelized workers.
edit_fin_energy_lmax(runtask)	modify FIN: replace the energy range (second line)
refcalc(sl, rp[, subdomain, parent_dir])	Main function to execute the reference calculation segment.
refcalc_domains(rp)	Runs reference calculations for the domains that require them.
runDomainRefcalc(dp)	Runs the reference calculation for one domain, based on the DomainParameters object.
run_refcalc(runtask)	Runs a part of a reference calculation in a subfolder, or the whole refcalc here if in single-threaded mode.

Classes

RefcalcCompileTask(param, lmax, ...[, basedir])	Stores information for a worker to compile a refcalc file, and keeps track of the folder that the compiled file is in afterwards.
RefcalcRunTask(fin, energy, comptask, logname)	Stores information for a worker to create a subfolder, copy input there, compile and run a reference calculation, and copy results back.