DiracParser.h File Reference

Include dependency graph for DiracParser.h:

This graph shows which files directly or indirectly include this file:

Go to the source code of this file.

Classes
struct	basisGroup
struct	atBasisSet
struct	fermIrrep
struct	ciState
class	cosciRep
class	DiracParser

Typedefs
using	primBasis = std::pair< double, double >

Enumerations
enum	OrbType { CORE, ACTIVE, VIRTUAL }

---

Class Documentation

basisGroup

struct basisGroup

Definition at line 22 of file DiracParser.h.

Collaboration diagram for basisGroup:

Class Members
int	l
int	n
vector< primBasis >	radfuncs

atBasisSet

struct atBasisSet

Definition at line 29 of file DiracParser.h.

Collaboration diagram for atBasisSet:

Class Members
vector< basisGroup >	basisGroups
string	elementType

ciState

struct ciState

Definition at line 55 of file DiracParser.h.

Collaboration diagram for ciState:

Class Members
vector< double >	coeffs
double	energy
vector< string >	occstrings

Typedef Documentation

primBasis

using primBasis = std::pair<double, double>

Definition at line 20 of file DiracParser.h.

Enumeration Type Documentation

OrbType

enum OrbType

strong

Enumerator
CORE
ACTIVE
VIRTUAL

Definition at line 35 of file DiracParser.h.

{
  CORE,
  ACTIVE,
  VIRTUAL
};