//////////////////////////////////////////////////////////////////////////////// // // Copyright (c) 2008 The Regents of the University of California // // This file is part of Qbox // // Qbox is distributed under the terms of the GNU General Public License // as published by the Free Software Foundation, either version 2 of // the License, or (at your option) any later version. // See the file COPYING in the root directory of this distribution // or . // //////////////////////////////////////////////////////////////////////////////// // // SDAIonicStepper.h: // //////////////////////////////////////////////////////////////////////////////// // $Id: SDAIonicStepper.h,v 1.12 2008-09-08 15:56:19 fgygi Exp $ #ifndef SDAIONICSTEPPER_H #define SDAIONICSTEPPER_H #include "IonicStepper.h" #include "LineMinimizer.h" #include class SDAIonicStepper : public IonicStepper { private: bool first_step_; std::vector > rc_; std::vector > pc_; std::vector > fc_; double ec_, fpc_; double alpha_, sigma1_, sigma2_; LineMinimizer linmin_; public: SDAIonicStepper(Sample& s) : IonicStepper(s), first_step_(true), sigma1_(0.1), sigma2_(0.3) { linmin_.set_sigma1(sigma1_); linmin_.set_sigma2(sigma2_); } void compute_r(double e0, const std::vector >& f0); void compute_v(double e0, const std::vector >& f0) {} }; #endif