3
0
mirror of https://github.com/triqs/dft_tools synced 2024-12-26 22:33:48 +01:00
dft_tools/triqs/gfs/deprecated/two_real_times.hpp
Olivier Parcollet 39edb2f846 [API change] gf : factories -> constructors
- Make more general constructors for the gf.
  gf( mesh, target_shape_t)
- remove the old make_gf for the basic gf.
- 2 var non generic gf removed.
- clean evaluator
- add tensor_valued
- add a simple vertex test.
- clean specialisation
- Fix bug introduced in 1906dc3
- forgot to resize the gf in new version of operator =
- Fix make_singularity in gf.hpp

- clean resize in operator =

- update h5 read/write for block gf
  - changed a bit the general trait to save *all* the gf.
  - allows a more general specialization, then a correct for blocks

- NOT FINISHED : need to save the block indice for python.
  How to reread ?
  Currently it read the blocks names and reconstitute the mesh from it.
  Is it sufficient ?

- clean block constructors

 - block constructors simplest possible : an int for the number of blocks
 - rest in free factories.
 - fixed the generic constructor from GfType for the regular type :
   only enable iif GfType is ImmutableGreenFunction

- multivar. fix linear index in C, and h5 format

  - linear index now correctly flatten in C mode
    (was in fortran mode), using a simple reverse of the tuple in the folding.
  - fix the h5 read write of the multivar fonctions
   in order to write an array on dimension # variables + dim_target
   i.e. without flattening the indices of the meshes.
   Easier for later data analysis, e.g. in Python.

- merge matrix/tensor_valued. improve factories

  - matrix_valued now = tensor_valued<2>
    (simplifies generic code for h5).
  - factories_one_var -> factories : this is the generic case ...
    only a few specialization, code is simpler.

- clef expression call with rvalue for *this
- generalize matrix_proxy to tensor and clean

 - clean exception catch in tests

  - exception catching catch in need in test
    because the silly OS X does not print anything, just "exception occurred".
    Very convenient for the developer...
  - BUT, one MUST add return 1, or the make test will *pass* !!
  - --> systematically replace the catch by a macro TRIQS_CATCH_AND_ABORT
    which return a non zero error code.
   - exception : curry_and_fourier which does not work at this stage
   (mesh incompatible).

- gf: clean draft of gf 2 times
  - comment the python interface for the moment.
  - rm useless tests
2013-10-21 15:11:44 +02:00

140 lines
5.8 KiB
C++

/*******************************************************************************
*
* TRIQS: a Toolbox for Research in Interacting Quantum Systems
*
* Copyright (C) 2012 by M. Ferrero, O. Parcollet
*
* TRIQS is free software: you can redistribute it and/or modify it under the
* terms of the GNU General Public License as published by the Free Software
* Foundation, either version 3 of the License, or (at your option) any later
* version.
*
* TRIQS is distributed in the hope that it will be useful, but WITHOUT ANY
* WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS
* FOR A PARTICULAR PURPOSE. See the GNU General Public License for more
* details.
*
* You should have received a copy of the GNU General Public License along with
* TRIQS. If not, see <http://www.gnu.org/licenses/>.
*
******************************************************************************/
#ifndef TRIQS_GF_TWO_TIMES_H
#define TRIQS_GF_TWO_TIMES_H
#include "./tools.hpp"
#include "./gf.hpp"
#include "./retime.hpp"
#include "./meshes/product.hpp"
namespace triqs { namespace gfs {
struct two_real_times {};
// the mesh
template<typename Opt> struct gf_mesh<two_real_times,Opt> :mesh_product<gf_mesh<retime,Opt> ,gf_mesh<retime,Opt> > {
typedef mesh_product<gf_mesh<retime,Opt> ,gf_mesh<retime,Opt> > B;
gf_mesh() = default;
gf_mesh (double tmax, double n_time_slices) :
B(gf_mesh<retime,Opt> ( 0, tmax,n_time_slices, full_bins),
gf_mesh<retime,Opt> ( 0, tmax,n_time_slices, full_bins) ) {}
};
namespace gfs_implementation {
/// --------------------------- closest mesh point on the grid ---------------------------------
template<typename Opt>
struct get_closest_point <two_real_times,matrix_valued,Opt> {
typedef typename gf_mesh<two_real_times, Opt>::type mesh_t;
// // NOT FINISHED, NOT TESTED
// template<typename G, typename T>
// static typename mesh_t::index_t invoke(G const * g, closest_pt_wrap<T,T> const & p) {
// return std::floor( double(p.value) / g->mesh().delta() + 0.5);
// }
};
// h5 name
template<typename Opt> struct h5_name<two_real_times,matrix_valued,Opt> { static std::string invoke(){ return "GfTwoRealTime";}};
template<typename Opt> struct h5_name<two_real_times,scalar_valued,Opt> { static std::string invoke(){ return "GfTwoRealTime_s";}};
/// --------------------------- evaluator ---------------------------------
template<typename Opt, typename Target>
struct evaluator<two_real_times,Target,Opt> {
static constexpr int arity = 2;
typedef typename std::conditional < std::is_same<Target, matrix_valued>::value, arrays::matrix<std::complex<double>>, std::complex<double>>::type rtype;
template<typename G>
rtype operator() (G const * g, double t0, double t1) const {
int n0,n1; double w0,w1; bool in;
std::tie(in, n0, w0) = windowing(std::get<0>(g->mesh().components()),t0);
if (!in) TRIQS_RUNTIME_ERROR <<" Evaluation out of bounds";
std::tie(in, n1, w1) = windowing(std::get<1>(g->mesh().components()),t1);
if (!in) TRIQS_RUNTIME_ERROR <<" Evaluation out of bounds";
auto gg = on_mesh(*g);
return (1-w0) * ( (1-w1) * gg(n0, n1) + w1 * gg(n0, n1+1) ) + w0 * ( (1-w1) * gg(n0+1, n1) + w1 * gg(n0+1, n1+1));
}
};
/// --------------------------- data access ---------------------------------
template<typename Opt> struct data_proxy<two_real_times,matrix_valued,Opt> : data_proxy_array<std::complex<double>,3> {};
template<typename Opt> struct data_proxy<two_real_times,scalar_valued,Opt> : data_proxy_array<std::complex<double>,1> {};
// ------------------------------- Factories --------------------------------------------------
//matrix_valued
template<typename Opt> struct factories<two_real_times, matrix_valued,Opt> {
typedef gf<two_real_times, matrix_valued,Opt> gf_t;
typedef gf_mesh<two_real_times, Opt> mesh_t;
typedef tqa::mini_vector<int,2> target_shape_t;
static gf_t make_gf(double tmax, double n_time_slices, tqa::mini_vector<int,2> shape) {
auto m = gf_mesh<two_real_times,Opt>(tmax, n_time_slices);
typename gf_t::data_regular_t A(shape.front_append(m.size())); A() =0;
return gf_t (m, std::move(A), nothing(), nothing() ) ;
}
};
//scalar_valued
template<typename Opt> struct factories<two_real_times, scalar_valued,Opt> {
typedef gf<two_real_times, scalar_valued,Opt> gf_t;
typedef gf_mesh<two_real_times, Opt> mesh_t;
struct target_shape_t {};
static gf_t make_gf(double tmax, double n_time_slices) {
auto m = gf_mesh<two_real_times,Opt>(tmax, n_time_slices);
typename gf_t::data_regular_t A(m.size()); A() =0;
return gf_t (m, std::move(A), nothing(), nothing() ) ;
}
};
} // gfs_implementation
// ------------------------------- Additionnal free function for this gf --------------------------------------------------
// from g(t,t') and t, return g(t-t') for any t'>t
//
inline gf<retime> slice (gf_view<two_real_times> const & g, double t) {
auto const & m = std::get<0> (g.mesh().components()); //one-time mesh
int it = get_closest_mesh_pt_index(m, t); //index of t on this mesh
int nt = m.size() - it;
if (it+1 < nt) nt = it+1 ; //nt=length of the resulting GF's mesh
double dt = m.delta();
auto res = gf<retime>{{0, 2*(nt-1)*dt, nt}, g(t,t).shape()};
res() = 0;
auto _ = arrays::range();// everyone
for(int sh=0; sh<nt; sh++){
res.data()(sh,_,_) = g.data()(g.mesh().index_to_linear(std::make_tuple( it+sh, it-sh) ),_,_);
}
return res;
}
// Get the 1 time mesh from the 2 times cartesian product (for cython interface mainly)
template<typename M>
auto get_1d_mesh_from_2times_mesh(M const & m) DECL_AND_RETURN(std::get<0>(m.components()));
}}
#endif