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Class List
Here are the classes, structs, unions and interfaces with brief descriptions:
create_three_particle_states
create_two_particle_states
density
electrostatic_potential
hydrogenvariation
orbital_density
plot_three_particle_contribution
plot_three_particle_states
plot_two_particle_states
run
run_app
AtomicBasisFunction
BasisFunction
BoysFunction
Calculates the Boys function efficiently for any argument and level
BoysFunctionIntermediate
Helper class for fast evaluations in
BoysFunction
ElectronSystem
Base class for any type of electronic system
GaussianColoumbAttractionIntegral
GaussianContractedOrbital
GaussianCore
Defines the position, charge and basis functions assigned to a nucleus
GaussianElectronInteractionIntegral
GaussianKineticIntegral
GaussianOverlapIntegral
GaussianPrimitiveOrbital
GaussianSystem
Electron system based on Gaussian type orbitals
GaussianTypeOrbital
HartreeFock
HartreeFockSolver
Base class for the Hartree-Fock type solvers
HartreeSolver
Solver using only a Hartree wave function
Helium
Deprecated test class for
Helium
system
HermiteExpansionCoefficient
Sets up and solves the recurrence relations for E used in all the integrals
HermiteIntegral
Sets up and solves the recurrence relations for R used in the Coulomb integrals
HF
HydrogenMolecule
Deprecated test class for Hydrogen molecule system
iequal_to
ihash
Method
MockBasisFunction
MultiHydrogen
Deprecated test class for Hydrogen molecule system
Output
QtQuick2ApplicationViewer
QtQuick2ApplicationViewerPrivate
RestrictedHartreeFockSolver
Solver for the Roothan equation
Texture3D
TurboMoleParser
UnrestrictedHartreeFockSolver
Vector3
Simple 3D vector class with focus on performance and readability
VolumeShaderProgram
VolumeShaderProgramEffect
VolumeShaderProgramPrivate
VolumeShaderProgramPropertyListener
VolumeShaderProgramPropertyListenerEx
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