28 #ifndef _math_optimize_qnewton_h
29 #define _math_optimize_qnewton_h
31 #include <util/state/state.h>
32 #include <util/class/class.h>
33 #include <math/scmat/matrix.h>
34 #include <math/optimize/function.h>
35 #include <math/optimize/opt.h>
36 #include <math/optimize/update.h>
47 int assume_converged_;
51 double maxabs_gradient;
58 int take_newton_step_;
65 int dynamic_grad_acc_;
The RefSymmSCMatrix class is a smart pointer to an SCSymmSCMatrix specialization.
Definition: matrix.h:265
A template class that maintains references counts.
Definition: ref.h:361
The Optimize class is an abstract base class for classes that find the extreme points of Function's.
Definition: opt.h:44
void save_data_state(StateOut &)
Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR ...
QNewtonOpt(const Ref< KeyVal > &)
The KeyVal constructor.
Definition: stateout.h:71
void print(std::ostream &=ExEnv::out0()) const
Print the object.
static std::ostream & out0()
Return an ostream that writes from node 0.
The QNewtonOpt implements a quasi-Newton optimization scheme.
Definition: qnewton.h:45
Contains all MPQC code up to version 3.
Definition: mpqcin.h:14
Generated at Sun Jan 26 2020 23:24:00 for MPQC
3.0.0-alpha using the documentation package Doxygen
1.8.16.