LORENE
scalar_raccord.C
1/*
2 * Copyright (c) 2003 Eric Gourgoulhon & Jerome Novak
3 *
4 * Copyright (c) 2000-2001 Philippe Grandclement (for preceding Cmp version)
5 *
6 * This file is part of LORENE.
7 *
8 * LORENE is free software; you can redistribute it and/or modify
9 * it under the terms of the GNU General Public License as published by
10 * the Free Software Foundation; either version 2 of the License, or
11 * (at your option) any later version.
12 *
13 * LORENE is distributed in the hope that it will be useful,
14 * but WITHOUT ANY WARRANTY; without even the implied warranty of
15 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
16 * GNU General Public License for more details.
17 *
18 * You should have received a copy of the GNU General Public License
19 * along with LORENE; if not, write to the Free Software
20 * Foundation, Inc., 59 Temple Place, Suite 330, Boston, MA 02111-1307 USA
21 *
22 */
23
24
25
26
27/*
28 * $Id: scalar_raccord.C,v 1.5 2016/12/05 16:18:19 j_novak Exp $
29 * $Log: scalar_raccord.C,v $
30 * Revision 1.5 2016/12/05 16:18:19 j_novak
31 * Suppression of some global variables (file names, loch, ...) to prevent redefinitions
32 *
33 * Revision 1.4 2014/10/13 08:53:47 j_novak
34 * Lorene classes and functions now belong to the namespace Lorene.
35 *
36 * Revision 1.3 2014/10/06 15:16:16 j_novak
37 * Modified #include directives to use c++ syntax.
38 *
39 * Revision 1.2 2003/10/01 13:04:44 e_gourgoulhon
40 * The method Tensor::get_mp() returns now a reference (and not
41 * a pointer) onto a mapping.
42 *
43 * Revision 1.1 2003/09/25 08:58:10 e_gourgoulhon
44 * First version.
45 *
46 *
47 * $Header: /cvsroot/Lorene/C++/Source/Tensor/Scalar/scalar_raccord.C,v 1.5 2016/12/05 16:18:19 j_novak Exp $
48 *
49 */
50
51//standard
52#include <cstdlib>
53
54// LORENE
55#include "tensor.h"
56#include "proto.h"
57#include "matrice.h"
58
59namespace Lorene {
60Matrice matrice_raccord_pair (int cont, double alpha_kernel) ;
61Matrice matrice_raccord_impair (int cont, double alpha_kernel) ;
62Tbl sec_membre_raccord (Tbl coef, int cont, double alpha_shell) ;
63Tbl regularise (Tbl coef, int nr, int base_r) ;
64
65void Scalar::raccord (int aux) {
66
67 assert (etat != ETATNONDEF) ;
68
69 assert (aux >=0) ;
70 int cont = aux+1 ;
71
72 const Map_af* mapping = dynamic_cast<const Map_af*>( mp ) ;
73
74 if (mapping == 0x0) {
75 cout <<
76 "Scalar::raccord : The mapping does not belong to the class Map_af !"
77 << endl ;
78 abort() ;
79 }
80
81 assert (mapping->get_mg()->get_type_r(1) == FIN) ;
82 assert (mapping->get_mg()->get_type_r(0) == RARE) ;
83
84 // On passe en Ylm et vire tout dans la zone interne...
85 va.coef() ;
86 va.ylm() ;
87 va.set_etat_cf_qcq() ;
88 va.c_cf->t[0]->annule_hard() ;
89
90 // Confort :
91 int nz = mapping->get_mg()->get_nzone() ;
92 int nbrer_kernel = mapping->get_mg()->get_nr(0) ;
93 int nbrer_shell = mapping->get_mg()->get_nr(1) ;
94
95 int nbret_kernel = mapping->get_mg()->get_nt(0) ;
96 int nbret_shell = mapping->get_mg()->get_nt(1) ;
97
98 int nbrep_kernel = mapping->get_mg()->get_np(0) ;
99 int nbrep_shell = mapping->get_mg()->get_np(1) ;
100
101 double alpha_kernel = mapping->get_alpha()[0] ;
102 double alpha_shell = mapping->get_alpha()[1] ;
103
104 int base_r, m_quant, l_quant ;
105
106 for (int k=0 ; k<nbrep_kernel+1 ; k++)
107 for (int j=0 ; j<nbret_kernel ; j++)
108 if (nullite_plm(j, nbret_kernel, k,nbrep_kernel, va.base) == 1)
109 if (nullite_plm(j, nbret_shell, k, nbrep_shell, va.base) == 1)
110 {
111 // calcul des nombres quantiques :
112 donne_lm(nz, 0, j, k, va.base, m_quant, l_quant, base_r) ;
113 assert ((base_r == R_CHEBP) || (base_r == R_CHEBI)) ;
114
115 Matrice systeme(cont, cont) ;
116
117 Tbl facteur (nbrer_kernel) ;
118 facteur.annule_hard() ;
119 for (int i=0 ; i<nbrer_shell ; i++)
120 if (i<nbrer_kernel)
121 facteur.set(i) = (*va.c_cf)(1, k, j, i) ;
122
123 Tbl sec_membre (sec_membre_raccord (facteur, cont, alpha_shell)) ;
124
125 if (base_r == R_CHEBP)
126 systeme = matrice_raccord_pair (cont, alpha_kernel) ;
127 else
128 systeme = matrice_raccord_impair (cont, alpha_kernel) ;
129
130 Tbl soluce (systeme.inverse(sec_membre)) ;
131 Tbl regulier (nbrer_kernel) ;
132
133 if (l_quant == 0)
134 for (int i=0 ; i<cont ; i++)
135 va.c_cf->set(0, k, j, i) = soluce(i) ;
136 else {
137 if (l_quant %2 == 0)
138 regulier = regularise (soluce, nbrer_kernel, R_CHEBP) ;
139 else
140 regulier = regularise (soluce, nbrer_kernel, R_CHEBI) ;
141
142 for (int i=0 ; i<nbrer_kernel ; i++)
143 va.c_cf->set(0, k, j, i) = regulier(i) ;
144 }
145 }
146 va.ylm_i() ;
147}
148}
Affine radial mapping.
Definition map.h:2042
const double * get_alpha() const
Returns the pointer on the array alpha.
Definition map_af.C:604
Matrix handling.
Definition matrice.h:152
Tbl inverse(const Tbl &sec_membre) const
Solves the linear system represented by the matrix.
Definition matrice.C:427
void raccord(int n)
Performs the matching of the nucleus with respect to the first shell.
int etat
The logical state ETATNONDEF (undefined), ETATZERO (null), ETATUN (one), or ETATQCQ (ordinary).
Definition scalar.h:402
Valeur va
The numerical value of the Scalar.
Definition scalar.h:411
Basic array class.
Definition tbl.h:161
void annule_hard()
Sets the Tbl to zero in a hard way.
Definition tbl.C:375
double & set(int i)
Read/write of a particular element (index i) (1D case).
Definition tbl.h:281
#define R_CHEBI
base de Cheb. impaire (rare) seulement
#define R_CHEBP
base de Cheb. paire (rare) seulement
const Map *const mp
Mapping on which the numerical values at the grid points are defined.
Definition tensor.h:301
Lorene prototypes.
Definition app_hor.h:67