QMCPACK
CubicSplineBasisSet< RT > Member List
This is the complete list of members for
CubicSplineBasisSet< RT >
, including all inherited members.
checkInVariablesExclusive
(opt_variables_type &active)=0
OptimizableFunctorBase
qmcplusplus::OptimizableObject::checkInVariablesExclusive
(opt_variables_type &active)=0
OptimizableObject
pure virtual
checkOutVariables
(const opt_variables_type &active)=0
OptimizableFunctorBase
pure virtual
CubicSplineBasisSet
()
CubicSplineBasisSet< RT >
inline
CubicSplineBasisSet
(FNIN *in_, grid_type *agrid)
CubicSplineBasisSet< RT >
inline
cutoff_radius
OptimizableFunctorBase
df
(real_type r) override
CubicSplineBasisSet< RT >
inline
virtual
evaluate
(real_type r, real_type &dudr, real_type &d2udr2)
CubicSplineBasisSet< RT >
inline
evaluate
(real_type r)
CubicSplineBasisSet< RT >
inline
evaluateDerivatives
(real_type r, std::vector< qmcplusplus::TinyVector< real_type, 3 >> &derivs)
OptimizableFunctorBase
inline
virtual
evaluateDerivatives
(real_type r, std::vector< real_type > &derivs)
OptimizableFunctorBase
inline
virtual
f
(real_type r) override
CubicSplineBasisSet< RT >
inline
virtual
FNIN
typedef
CubicSplineBasisSet< RT >
FNOUT
typedef
CubicSplineBasisSet< RT >
getIndex
(const opt_variables_type &active)
OptimizableFunctorBase
inline
getName
() const
OptimizableObject
inline
grid_type
typedef
CubicSplineBasisSet< RT >
GridDelta
CubicSplineBasisSet< RT >
InFunc
CubicSplineBasisSet< RT >
initialize
(FNIN *in_, grid_type *agrid)
CubicSplineBasisSet< RT >
inline
isOptimized
() const
OptimizableObject
inline
makeClone
() const =0
OptimizableFunctorBase
pure virtual
myVars
OptimizableFunctorBase
NumGridPoints
CubicSplineBasisSet< RT >
opt_variables_type
typedef
OptimizableFunctorBase
OptimizableFunctorBase
(const std::string &name="")
OptimizableFunctorBase
inline
OptimizableObject
(const std::string &name)
OptimizableObject
inline
OutFunc
CubicSplineBasisSet< RT >
print
(std::ostream &os)
CubicSplineBasisSet< RT >
inline
put
(xmlNodePtr cur) override
CubicSplineBasisSet< RT >
inline
virtual
readVariationalParameters
(hdf_archive &hin)
OptimizableObject
inline
virtual
real_type
typedef
OptimizableFunctorBase
reportStatus
(std::ostream &os)
OptimizableObject
inline
virtual
reset
() override
CubicSplineBasisSet< RT >
inline
virtual
resetParametersExclusive
(const opt_variables_type &active) override
CubicSplineBasisSet< RT >
inline
virtual
qmcplusplus::OptimizableFunctorBase::resetParametersExclusive
(const opt_variables_type &active)=0
OptimizableFunctorBase
Rmax
CubicSplineBasisSet< RT >
setCusp
(real_type cusp)
OptimizableFunctorBase
inline
virtual
setDensity
(real_type n)
OptimizableFunctorBase
inline
virtual
setGridManager
(bool willmanage)
OptimizableFunctorBase
inline
virtual
setInFunc
(FNIN *in_)
CubicSplineBasisSet< RT >
inline
setOptimization
(bool state)
OptimizableObject
inline
setOutFunc
(FNOUT *out_)
CubicSplineBasisSet< RT >
inline
setPeriodic
(bool periodic)
OptimizableFunctorBase
inline
virtual
writeVariationalParameters
(hdf_archive &hout)
OptimizableObject
inline
virtual
~OptimizableFunctorBase
()=default
OptimizableFunctorBase
virtual
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