oeprop: Compute One-Electron Properties

Files
file	compute_density.cc
	Compute the density for Hartree-Fock wavefunctions.
file	connectivity.cc
	Enter brief description of file here.
file	fza.cc
	fza returns extraplated values of QED function F(Z*alpha), tables for which have been tabulated by Mohr and co-workers. These are the n=1 values (there is a small n dependence). See Pyykko et al Phys. Rev. A 63, 024502.
file	get_nmo.cc
	Enter brief description of file here.
file	get_opdm_lbl.cc
	Enter brief description of file here.
file	oeprop/globals.h
	Enter brief description of file here.
file	grid.cc
	Enter brief description of file here.
file	grid_dens_2d.cc
	Enter brief description of file here.
file	grid_dens_3d.cc
	Enter brief description of file here.
file	grid_mo.cc
	Enter brief description of file here.
file	grid_oeprop.cc
	Enter brief description of file here.
file	grid_unitvec.cc
	Enter brief description of file here.
file	oeprop/includes.h
	Enter brief description of file here.
file	initialize.cc
	Enter brief description of file here.
file	oeprop/main.cc
	Enter brief description of file here.
file	oeprop/misc.cc
	Enter brief description of file here.
file	mprefxyz.cc
	Enter brief description of file here.
file	oeprop.cc
	Compute One-Electron Properties.
file	bin/oeprop/overlap.cc
	Enter brief description of file here.
file	oeprop/parsing.cc
	Enter brief description of file here.
file	populate.cc
	Enter brief description of file here.
file	oeprop/print.cc
	Enter brief description of file here.
file	print_grid.cc
	Enter brief description of file here.
file	prototypes.h
	Enter brief description of file here.
file	read_basset.cc
	Enter brief description of file here.
file	read_density.cc
	Enter brief description of file here.
file	recursion.cc
	Enter brief description of file here.

---

Detailed Description