MPQC 2.3.1

- Main Page
- Related Pages
- Classes
- Files

- File List

linkage.h

    00001 //
    00002 // linkage.h
    00003 //
    00004 // Copyright (C) 1997 Limit Point Systems, Inc.
    00005 //
    00006 // Author: Curtis Janssen <cljanss@limitpt.com>
    00007 // Maintainer: LPS
    00008 //
    00009 // This file is part of the SC Toolkit.
    00010 //
    00011 // The SC Toolkit is free software; you can redistribute it and/or modify
    00012 // it under the terms of the GNU Library General Public License as published by
    00013 // the Free Software Foundation; either version 2, or (at your option)
    00014 // any later version.
    00015 //
    00016 // The SC Toolkit is distributed in the hope that it will be useful,
    00017 // but WITHOUT ANY WARRANTY; without even the implied warranty of
    00018 // MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
    00019 // GNU Library General Public License for more details.
    00020 //
    00021 // You should have received a copy of the GNU Library General Public License
    00022 // along with the SC Toolkit; see the file COPYING.LIB.  If not, write to
    00023 // the Free Software Foundation, 675 Mass Ave, Cambridge, MA 02139, USA.
    00024 //
    00025 // The U.S. Government is granted a limited license as per AL 91-7.
    00026 //
    00027
    00028 #ifndef _chemistry_qc_dft_linkage_h
    00029 #define _chemistry_qc_dft_linkage_h
    00030
    00031 #include <chemistry/qc/dft/clks.h>
    00032 #include <chemistry/qc/dft/uks.h>
    00033 #include <chemistry/qc/dft/hsosks.h>
    00034 #include <chemistry/qc/dft/integrator.h>
    00035 #include <chemistry/qc/dft/functional.h>
    00036
    00037 namespace sc {
    00038
    00039 static ForceLink<RadialAngularIntegrator> dft_force_link_a_;
    00040 static ForceLink<NElFunctional> dft_force_link_b_;
    00041 static ForceLink<XalphaFunctional> dft_force_link_c_;
    00042 static ForceLink<SlaterXFunctional> dft_force_link_d_;
    00043 static ForceLink<Becke88XFunctional> dft_force_link_e_;
    00044 static ForceLink<LYPCFunctional> dft_force_link_f_;
    00045 static ForceLink<CLKS> dft_force_link_h_;
    00046 static ForceLink<UKS> dft_force_link_i_;
    00047 static ForceLink<VWN5LCFunctional> dft_force_link_j_;
    00048 static ForceLink<VWN3LCFunctional> dft_force_link_k_;
    00049 static ForceLink<PW92LCFunctional> dft_force_link_l_;
    00050 static ForceLink<PBEXFunctional> dft_force_link_m_;
    00051 static ForceLink<PBECFunctional> dft_force_link_n_;
    00052 static ForceLink<P86CFunctional> dft_force_link_o_;
    00053 static ForceLink<PW91XFunctional> dft_force_link_p_;
    00054 static ForceLink<PW86XFunctional> dft_force_link_q_;
    00055 static ForceLink<PZ81LCFunctional> dft_force_link_r_;
    00056 static ForceLink<G96XFunctional> dft_force_link_s_;
    00057 static ForceLink<VWN1LCFunctional> dft_force_link_t_;
    00058 static ForceLink<VWN2LCFunctional> dft_force_link_u_;
    00059 static ForceLink<VWN4LCFunctional> dft_force_link_v_;
    00060 static ForceLink<PW91CFunctional> dft_force_link_w_;
    00061 static ForceLink<HSOSKS> dft_force_link_x_;
    00062 static ForceLink<VWNLCFunctional> dft_force_link_y_;
    00063 static ForceLink<NewP86CFunctional> dft_force_link_z_;
    00064
    00065 }
    00066
    00067 #endif