示例#1
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文件: gf.cpp 项目: TRIQS/triqs
 block_gf<legendre> atomic_g_l(gf_lehmann_t<Complex> const &lehmann, gf_struct_t const &gf_struct, gf_mesh<legendre> const &mesh) {
   double beta = mesh.domain().beta;
   auto g      = block_gf{mesh, gf_struct};
   fill_block_gf_from_lehmann<Complex>(g(), lehmann, make_term_proc<Complex>(beta, g()));
   return g;
 }
示例#2
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 template <typename Opt> gf_mesh<imfreq, Opt> make_mesh_fourier_compatible(gf_mesh<imtime, Opt> const& m) {
  int L = m.size() - (m.kind() == full_bins ? 1 : 0);
  return {m.domain(), L};
 }
示例#3
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 gf_mesh<imtime, Opt> make_mesh_fourier_compatible(gf_mesh<imfreq, Opt> const& m, mesh_kind mk = full_bins) {
  int L = m.size() + (mk == full_bins ? 1 : 0);
  return {m.domain(), L};
 }
示例#4
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 // -------------- HDF5  --------------------------
 /// Write into HDF5
 friend void h5_write(h5::group fg, std::string subgroup_name, gf_mesh const& m) {
  h5::group gr = fg.create_group(subgroup_name);
  h5_write(gr, "domain", m.domain());
  h5_write(gr, "n_pts", m.dims[2]);
  //h5_write(gr, "dims", m.dims.to_vector());
 }
示例#5
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 friend gf_mesh mpi_gather(gf_mesh m, mpi::communicator c, int root) {
  return gf_mesh{m.domain(), m.size(), m.positive_only()};
 }
示例#6
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 /// Scatter a mesh over the communicator c
 friend gf_mesh mpi_scatter(gf_mesh m, mpi::communicator c, int root) {
  auto m2 = gf_mesh{m.domain(), m.size(), m.positive_only()};
  std::tie(m2._first_index_window, m2._last_index_window) = mpi::slice_range(m2._first_index, m2._last_index, c.size(), c.rank());
  return m2;
 }
示例#7
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 mesh_point(gf_mesh<imfreq> const &mesh, index_t const &index_)
    : matsubara_freq(index_, mesh.domain().beta, mesh.domain().statistic)
    , first_index_window(mesh.first_index_window())
    , last_index_window(mesh.last_index_window()) {}
示例#8
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 /// Write into HDF5
 friend void h5_write(h5::group fg, std::string subgroup_name, gf_mesh const &m) {
  h5::group gr = fg.create_group(subgroup_name);
  h5_write(gr, "domain", m.domain());
  h5_write(gr, "size", long(m.size()));
  h5_write(gr, "positive_freq_only", (m._positive_only?1:0));
 }