Path Integral Quantum Monte Carlo
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Implementation of a Jastrow trial wave function suitable for He. More...
#include <wavefunction.h>
Public Member Functions | |
JastrowWaveFunction (const Path &, LookupTable &_lookup, string _name="Jastrow") | |
Constructor. | |
~JastrowWaveFunction () | |
Destructor. | |
double | PsiTrial (const double) |
The value of the 2-body trial wave function. | |
double | PsiTrial (const int) |
The value of the trial wave function. | |
double | delPsiTrial (const double r) |
The derivative of psi over psi. | |
double | delSqPsiTrial (const double r) |
The derivative of psi over psi. | |
double | gradSqPsiTrial (const int) |
The value of the N-body trial wave function. | |
double | twoBodyPsiTrial (const double) |
Public Member Functions inherited from WaveFunctionBase | |
WaveFunctionBase (const Path &, LookupTable &_lookup, string _name="constant") | |
Setup the path data members for the constant trial wavefunction. | |
virtual | ~WaveFunctionBase () |
Empty base constructor. | |
virtual double | PsiTrial (const beadLocator &) |
Additional Inherited Members | |
Data Fields inherited from WaveFunctionBase | |
string | name |
Name of the trial wave function. | |
Protected Attributes inherited from WaveFunctionBase | |
const Path & | path |
A reference to the paths. | |
LookupTable & | lookup |
We need a non-constant reference for updates. | |
Implementation of a Jastrow trial wave function suitable for He.
Definition at line 78 of file wavefunction.h.