ergo
source Directory Reference

Directories

directory  basisset
 
directory  ci
 
directory  densfromf
 
directory  dft
 
directory  electron_dynamics
 
directory  integrals
 
directory  matrix
 
directory  scf
 
directory  tddft
 
directory  test
 
directory  utilities
 
directory  utilities_basic
 
directory  utilities_cht
 

Files

file  bin2m.cc
 A program for conversion of binary matrix file to a matlab format file.
 
file  config.h [code]
 
file  ergo_input_parser.c
 The lex input parser.
 
file  ergo_input_processor.c
 Parses the input.
 
file  ergo_input_processor.h [code]
 
file  ergo_scripted.cc
 The main program for the ergo project.
 
file  ergo_scripted.h [code]
 contains ergo input processor definitions.
 
file  fermi_contact.cc
 implements "Fermi contact" integrals.
 
file  license.h [code]
 
file  matrix_typedefs.h [code]
 Header file with typedefs for matrix and vector types.
 
file  slr.cc
 contains a Simple Linear Response implementation based on the MO orbital picture.
 
file  slr.h [code]