TABLE OF CONTENTS


ABINIT/ptg_Th [ Functions ]

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NAME

 ptg_Th

FUNCTION

COPYRIGHT

 Copyright (C) 2010-2022 ABINIT group (MG)
 This file is distributed under the terms of the
 GNU General Public License, see ~abinit/COPYING
 or http://www.gnu.org/copyleft/gpl.txt .
 For the initials of contributors, see ~abinit/doc/developers/contributors.txt .

INPUTS

OUTPUT

SOURCE

 21 !********************************************************************************
 22 ! This include file has been automatically generated by the script ptg.py
 23 ! Do not edit! Change the script source instead.
 24 !********************************************************************************
 25 
 26 ! Point group name  Th (m-3)
 27 
 28 #if defined HAVE_CONFIG_H
 29 #include "config.h"
 30 #endif
 31 
 32 #include "abi_common.h"
 33 
 34 module m_ptg_Th
 35 
 36 #ifdef FC_INTEL
 37 !DEC$ NOOPTIMIZE
 38 #endif
 39 
 40 contains
 41 !!**
 42 
 43  subroutine ptg_Th (nsym,nclass,sym,class_ids,class_names,Irr)
 44 
 45  use defs_basis
 46  use m_abicore
 47  use m_defs_ptgroups,  only : irrep_t
 48  implicit none
 49 !Arguments ------------------------------------
 50  integer,intent(out) :: nclass,nsym
 51  !arrays
 52  integer,allocatable,intent(out) :: sym(:,:,:), class_ids(:,:)
 53  character(len=5),allocatable,intent(out) :: class_names(:)
 54  type(irrep_t),allocatable,intent(out) :: Irr(:)
 55  !Local variables-------------------------------
 56  complex(dpc) :: j=(0.0_dp,1.0_dp)
 57  ! ********************************************************************************
 58 ! List of symmetries packed in classes
 59  nsym = 24
 60  ABI_MALLOC(sym, (3,3,nsym))
 61  sym(:,:,1) = RESHAPE( (/1, 0, 0, 0, 1, 0, 0, 0, 1/) ,(/3,3/) )
 62  sym(:,:,2) = RESHAPE( (/-1, 0, 0, 0, -1, 0, 0, 0, 1/) ,(/3,3/) )
 63  sym(:,:,3) = RESHAPE( (/-1, 0, 0, 0, 1, 0, 0, 0, -1/) ,(/3,3/) )
 64  sym(:,:,4) = RESHAPE( (/1, 0, 0, 0, -1, 0, 0, 0, -1/) ,(/3,3/) )
 65  sym(:,:,5) = RESHAPE( (/0, 1, 0, 0, 0, 1, 1, 0, 0/) ,(/3,3/) )
 66  sym(:,:,6) = RESHAPE( (/0, -1, 0, 0, 0, -1, 1, 0, 0/) ,(/3,3/) )
 67  sym(:,:,7) = RESHAPE( (/0, -1, 0, 0, 0, 1, -1, 0, 0/) ,(/3,3/) )
 68  sym(:,:,8) = RESHAPE( (/0, 1, 0, 0, 0, -1, -1, 0, 0/) ,(/3,3/) )
 69  sym(:,:,9) = RESHAPE( (/0, 0, 1, 1, 0, 0, 0, 1, 0/) ,(/3,3/) )
 70  sym(:,:,10) = RESHAPE( (/0, 0, -1, -1, 0, 0, 0, 1, 0/) ,(/3,3/) )
 71  sym(:,:,11) = RESHAPE( (/0, 0, -1, 1, 0, 0, 0, -1, 0/) ,(/3,3/) )
 72  sym(:,:,12) = RESHAPE( (/0, 0, 1, -1, 0, 0, 0, -1, 0/) ,(/3,3/) )
 73  sym(:,:,13) = RESHAPE( (/-1, 0, 0, 0, -1, 0, 0, 0, -1/) ,(/3,3/) )
 74  sym(:,:,14) = RESHAPE( (/1, 0, 0, 0, 1, 0, 0, 0, -1/) ,(/3,3/) )
 75  sym(:,:,15) = RESHAPE( (/1, 0, 0, 0, -1, 0, 0, 0, 1/) ,(/3,3/) )
 76  sym(:,:,16) = RESHAPE( (/-1, 0, 0, 0, 1, 0, 0, 0, 1/) ,(/3,3/) )
 77  sym(:,:,17) = RESHAPE( (/0, -1, 0, 0, 0, -1, -1, 0, 0/) ,(/3,3/) )
 78  sym(:,:,18) = RESHAPE( (/0, 1, 0, 0, 0, 1, -1, 0, 0/) ,(/3,3/) )
 79  sym(:,:,19) = RESHAPE( (/0, 1, 0, 0, 0, -1, 1, 0, 0/) ,(/3,3/) )
 80  sym(:,:,20) = RESHAPE( (/0, -1, 0, 0, 0, 1, 1, 0, 0/) ,(/3,3/) )
 81  sym(:,:,21) = RESHAPE( (/0, 0, -1, -1, 0, 0, 0, -1, 0/) ,(/3,3/) )
 82  sym(:,:,22) = RESHAPE( (/0, 0, 1, 1, 0, 0, 0, -1, 0/) ,(/3,3/) )
 83  sym(:,:,23) = RESHAPE( (/0, 0, 1, -1, 0, 0, 0, 1, 0/) ,(/3,3/) )
 84  sym(:,:,24) = RESHAPE( (/0, 0, -1, 1, 0, 0, 0, 1, 0/) ,(/3,3/) )
 85 
 86 ! Number of classes and corresponding indeces
 87  nclass = 8
 88  ABI_MALLOC(class_ids, (2,nclass))
 89  class_ids(1,1) = 1
 90  class_ids(2,1) = 1
 91  class_ids(1,2) = 2
 92  class_ids(2,2) = 4
 93  class_ids(1,3) = 5
 94  class_ids(2,3) = 8
 95  class_ids(1,4) = 9
 96  class_ids(2,4) = 12
 97  class_ids(1,5) = 13
 98  class_ids(2,5) = 13
 99  class_ids(1,6) = 14
100  class_ids(2,6) = 16
101  class_ids(1,7) = 17
102  class_ids(2,7) = 20
103  class_ids(1,8) = 21
104  class_ids(2,8) = 24
105 
106 ABI_MALLOC(class_names,(8))
107  class_names(1) = "1+"
108  class_names(2) = "2+"
109  class_names(3) = "3+"
110  class_names(4) = "3+"
111  class_names(5) = "-2-"
112  class_names(6) = "-2+"
113  class_names(7) = "-6-"
114  class_names(8) = "-6-"
115 
116 ! List of irreducible representations.
117  ABI_MALLOC(Irr, (8))
118  Irr(1)%name = "Ag"
119  Irr(1)%dim = 1
120  Irr(1)%nsym = 24
121  ABI_MALLOC(Irr(1)%mat, (1,1,24))
122  Irr(1)%mat(:,:,1) =  RESHAPE( (/1.0/), (/1, 1/) )
123  Irr(1)%mat(:,:,2) =  RESHAPE( (/1.0/), (/1, 1/) )
124  Irr(1)%mat(:,:,3) =  RESHAPE( (/1.0/), (/1, 1/) )
125  Irr(1)%mat(:,:,4) =  RESHAPE( (/1.0/), (/1, 1/) )
126  Irr(1)%mat(:,:,5) =  RESHAPE( (/1.0/), (/1, 1/) )
127  Irr(1)%mat(:,:,6) =  RESHAPE( (/1.0/), (/1, 1/) )
128  Irr(1)%mat(:,:,7) =  RESHAPE( (/1.0/), (/1, 1/) )
129  Irr(1)%mat(:,:,8) =  RESHAPE( (/1.0/), (/1, 1/) )
130  Irr(1)%mat(:,:,9) =  RESHAPE( (/1.0/), (/1, 1/) )
131  Irr(1)%mat(:,:,10) =  RESHAPE( (/1.0/), (/1, 1/) )
132  Irr(1)%mat(:,:,11) =  RESHAPE( (/1.0/), (/1, 1/) )
133  Irr(1)%mat(:,:,12) =  RESHAPE( (/1.0/), (/1, 1/) )
134  Irr(1)%mat(:,:,13) =  RESHAPE( (/1.0/), (/1, 1/) )
135  Irr(1)%mat(:,:,14) =  RESHAPE( (/1.0/), (/1, 1/) )
136  Irr(1)%mat(:,:,15) =  RESHAPE( (/1.0/), (/1, 1/) )
137  Irr(1)%mat(:,:,16) =  RESHAPE( (/1.0/), (/1, 1/) )
138  Irr(1)%mat(:,:,17) =  RESHAPE( (/1.0/), (/1, 1/) )
139  Irr(1)%mat(:,:,18) =  RESHAPE( (/1.0/), (/1, 1/) )
140  Irr(1)%mat(:,:,19) =  RESHAPE( (/1.0/), (/1, 1/) )
141  Irr(1)%mat(:,:,20) =  RESHAPE( (/1.0/), (/1, 1/) )
142  Irr(1)%mat(:,:,21) =  RESHAPE( (/1.0/), (/1, 1/) )
143  Irr(1)%mat(:,:,22) =  RESHAPE( (/1.0/), (/1, 1/) )
144  Irr(1)%mat(:,:,23) =  RESHAPE( (/1.0/), (/1, 1/) )
145  Irr(1)%mat(:,:,24) =  RESHAPE( (/1.0/), (/1, 1/) )
146 
147  Irr(2)%name = "Au"
148  Irr(2)%dim = 1
149  Irr(2)%nsym = 24
150  ABI_MALLOC(Irr(2)%mat, (1,1,24))
151  Irr(2)%mat(:,:,1) =  RESHAPE( (/1.0/), (/1, 1/) )
152  Irr(2)%mat(:,:,2) =  RESHAPE( (/1.0/), (/1, 1/) )
153  Irr(2)%mat(:,:,3) =  RESHAPE( (/1.0/), (/1, 1/) )
154  Irr(2)%mat(:,:,4) =  RESHAPE( (/1.0/), (/1, 1/) )
155  Irr(2)%mat(:,:,5) =  RESHAPE( (/1.0/), (/1, 1/) )
156  Irr(2)%mat(:,:,6) =  RESHAPE( (/1.0/), (/1, 1/) )
157  Irr(2)%mat(:,:,7) =  RESHAPE( (/1.0/), (/1, 1/) )
158  Irr(2)%mat(:,:,8) =  RESHAPE( (/1.0/), (/1, 1/) )
159  Irr(2)%mat(:,:,9) =  RESHAPE( (/1.0/), (/1, 1/) )
160  Irr(2)%mat(:,:,10) =  RESHAPE( (/1.0/), (/1, 1/) )
161  Irr(2)%mat(:,:,11) =  RESHAPE( (/1.0/), (/1, 1/) )
162  Irr(2)%mat(:,:,12) =  RESHAPE( (/1.0/), (/1, 1/) )
163  Irr(2)%mat(:,:,13) =  RESHAPE( (/-1.0/), (/1, 1/) )
164  Irr(2)%mat(:,:,14) =  RESHAPE( (/-1.0/), (/1, 1/) )
165  Irr(2)%mat(:,:,15) =  RESHAPE( (/-1.0/), (/1, 1/) )
166  Irr(2)%mat(:,:,16) =  RESHAPE( (/-1.0/), (/1, 1/) )
167  Irr(2)%mat(:,:,17) =  RESHAPE( (/-1.0/), (/1, 1/) )
168  Irr(2)%mat(:,:,18) =  RESHAPE( (/-1.0/), (/1, 1/) )
169  Irr(2)%mat(:,:,19) =  RESHAPE( (/-1.0/), (/1, 1/) )
170  Irr(2)%mat(:,:,20) =  RESHAPE( (/-1.0/), (/1, 1/) )
171  Irr(2)%mat(:,:,21) =  RESHAPE( (/-1.0/), (/1, 1/) )
172  Irr(2)%mat(:,:,22) =  RESHAPE( (/-1.0/), (/1, 1/) )
173  Irr(2)%mat(:,:,23) =  RESHAPE( (/-1.0/), (/1, 1/) )
174  Irr(2)%mat(:,:,24) =  RESHAPE( (/-1.0/), (/1, 1/) )
175 
176  Irr(3)%name = "Eg1"
177  Irr(3)%dim = 1
178  Irr(3)%nsym = 24
179  ABI_MALLOC(Irr(3)%mat, (1,1,24))
180  Irr(3)%mat(:,:,1) =  RESHAPE( (/1.0/), (/1, 1/) )
181  Irr(3)%mat(:,:,2) =  RESHAPE( (/1.0/), (/1, 1/) )
182  Irr(3)%mat(:,:,3) =  RESHAPE( (/1.0/), (/1, 1/) )
183  Irr(3)%mat(:,:,4) =  RESHAPE( (/1.0/), (/1, 1/) )
184  Irr(3)%mat(:,:,5) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
185  Irr(3)%mat(:,:,6) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
186  Irr(3)%mat(:,:,7) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
187  Irr(3)%mat(:,:,8) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
188  Irr(3)%mat(:,:,9) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
189  Irr(3)%mat(:,:,10) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
190  Irr(3)%mat(:,:,11) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
191  Irr(3)%mat(:,:,12) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
192  Irr(3)%mat(:,:,13) =  RESHAPE( (/1.0/), (/1, 1/) )
193  Irr(3)%mat(:,:,14) =  RESHAPE( (/1.0/), (/1, 1/) )
194  Irr(3)%mat(:,:,15) =  RESHAPE( (/1.0/), (/1, 1/) )
195  Irr(3)%mat(:,:,16) =  RESHAPE( (/1.0/), (/1, 1/) )
196  Irr(3)%mat(:,:,17) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
197  Irr(3)%mat(:,:,18) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
198  Irr(3)%mat(:,:,19) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
199  Irr(3)%mat(:,:,20) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
200  Irr(3)%mat(:,:,21) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
201  Irr(3)%mat(:,:,22) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
202  Irr(3)%mat(:,:,23) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
203  Irr(3)%mat(:,:,24) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
204 
205  Irr(4)%name = "Eu1"
206  Irr(4)%dim = 1
207  Irr(4)%nsym = 24
208  ABI_MALLOC(Irr(4)%mat, (1,1,24))
209  Irr(4)%mat(:,:,1) =  RESHAPE( (/1.0/), (/1, 1/) )
210  Irr(4)%mat(:,:,2) =  RESHAPE( (/1.0/), (/1, 1/) )
211  Irr(4)%mat(:,:,3) =  RESHAPE( (/1.0/), (/1, 1/) )
212  Irr(4)%mat(:,:,4) =  RESHAPE( (/1.0/), (/1, 1/) )
213  Irr(4)%mat(:,:,5) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
214  Irr(4)%mat(:,:,6) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
215  Irr(4)%mat(:,:,7) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
216  Irr(4)%mat(:,:,8) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
217  Irr(4)%mat(:,:,9) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
218  Irr(4)%mat(:,:,10) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
219  Irr(4)%mat(:,:,11) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
220  Irr(4)%mat(:,:,12) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
221  Irr(4)%mat(:,:,13) =  RESHAPE( (/-1.0/), (/1, 1/) )
222  Irr(4)%mat(:,:,14) =  RESHAPE( (/-1.0/), (/1, 1/) )
223  Irr(4)%mat(:,:,15) =  RESHAPE( (/-1.0/), (/1, 1/) )
224  Irr(4)%mat(:,:,16) =  RESHAPE( (/-1.0/), (/1, 1/) )
225  Irr(4)%mat(:,:,17) =  RESHAPE( (/0.5-0.86603*j/), (/1, 1/) )
226  Irr(4)%mat(:,:,18) =  RESHAPE( (/0.5-0.86603*j/), (/1, 1/) )
227  Irr(4)%mat(:,:,19) =  RESHAPE( (/0.5-0.86603*j/), (/1, 1/) )
228  Irr(4)%mat(:,:,20) =  RESHAPE( (/0.5-0.86603*j/), (/1, 1/) )
229  Irr(4)%mat(:,:,21) =  RESHAPE( (/0.5+0.86603*j/), (/1, 1/) )
230  Irr(4)%mat(:,:,22) =  RESHAPE( (/0.5+0.86603*j/), (/1, 1/) )
231  Irr(4)%mat(:,:,23) =  RESHAPE( (/0.5+0.86603*j/), (/1, 1/) )
232  Irr(4)%mat(:,:,24) =  RESHAPE( (/0.5+0.86603*j/), (/1, 1/) )
233 
234  Irr(5)%name = "Eg2"
235  Irr(5)%dim = 1
236  Irr(5)%nsym = 24
237  ABI_MALLOC(Irr(5)%mat, (1,1,24))
238  Irr(5)%mat(:,:,1) =  RESHAPE( (/1.0/), (/1, 1/) )
239  Irr(5)%mat(:,:,2) =  RESHAPE( (/1.0/), (/1, 1/) )
240  Irr(5)%mat(:,:,3) =  RESHAPE( (/1.0/), (/1, 1/) )
241  Irr(5)%mat(:,:,4) =  RESHAPE( (/1.0/), (/1, 1/) )
242  Irr(5)%mat(:,:,5) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
243  Irr(5)%mat(:,:,6) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
244  Irr(5)%mat(:,:,7) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
245  Irr(5)%mat(:,:,8) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
246  Irr(5)%mat(:,:,9) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
247  Irr(5)%mat(:,:,10) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
248  Irr(5)%mat(:,:,11) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
249  Irr(5)%mat(:,:,12) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
250  Irr(5)%mat(:,:,13) =  RESHAPE( (/1.0/), (/1, 1/) )
251  Irr(5)%mat(:,:,14) =  RESHAPE( (/1.0/), (/1, 1/) )
252  Irr(5)%mat(:,:,15) =  RESHAPE( (/1.0/), (/1, 1/) )
253  Irr(5)%mat(:,:,16) =  RESHAPE( (/1.0/), (/1, 1/) )
254  Irr(5)%mat(:,:,17) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
255  Irr(5)%mat(:,:,18) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
256  Irr(5)%mat(:,:,19) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
257  Irr(5)%mat(:,:,20) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
258  Irr(5)%mat(:,:,21) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
259  Irr(5)%mat(:,:,22) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
260  Irr(5)%mat(:,:,23) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
261  Irr(5)%mat(:,:,24) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
262 
263  Irr(6)%name = "Eu2"
264  Irr(6)%dim = 1
265  Irr(6)%nsym = 24
266  ABI_MALLOC(Irr(6)%mat, (1,1,24))
267  Irr(6)%mat(:,:,1) =  RESHAPE( (/1.0/), (/1, 1/) )
268  Irr(6)%mat(:,:,2) =  RESHAPE( (/1.0/), (/1, 1/) )
269  Irr(6)%mat(:,:,3) =  RESHAPE( (/1.0/), (/1, 1/) )
270  Irr(6)%mat(:,:,4) =  RESHAPE( (/1.0/), (/1, 1/) )
271  Irr(6)%mat(:,:,5) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
272  Irr(6)%mat(:,:,6) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
273  Irr(6)%mat(:,:,7) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
274  Irr(6)%mat(:,:,8) =  RESHAPE( (/-0.5-0.86603*j/), (/1, 1/) )
275  Irr(6)%mat(:,:,9) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
276  Irr(6)%mat(:,:,10) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
277  Irr(6)%mat(:,:,11) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
278  Irr(6)%mat(:,:,12) =  RESHAPE( (/-0.5+0.86603*j/), (/1, 1/) )
279  Irr(6)%mat(:,:,13) =  RESHAPE( (/-1.0/), (/1, 1/) )
280  Irr(6)%mat(:,:,14) =  RESHAPE( (/-1.0/), (/1, 1/) )
281  Irr(6)%mat(:,:,15) =  RESHAPE( (/-1.0/), (/1, 1/) )
282  Irr(6)%mat(:,:,16) =  RESHAPE( (/-1.0/), (/1, 1/) )
283  Irr(6)%mat(:,:,17) =  RESHAPE( (/0.5+0.86603*j/), (/1, 1/) )
284  Irr(6)%mat(:,:,18) =  RESHAPE( (/0.5+0.86603*j/), (/1, 1/) )
285  Irr(6)%mat(:,:,19) =  RESHAPE( (/0.5+0.86603*j/), (/1, 1/) )
286  Irr(6)%mat(:,:,20) =  RESHAPE( (/0.5+0.86603*j/), (/1, 1/) )
287  Irr(6)%mat(:,:,21) =  RESHAPE( (/0.5-0.86603*j/), (/1, 1/) )
288  Irr(6)%mat(:,:,22) =  RESHAPE( (/0.5-0.86603*j/), (/1, 1/) )
289  Irr(6)%mat(:,:,23) =  RESHAPE( (/0.5-0.86603*j/), (/1, 1/) )
290  Irr(6)%mat(:,:,24) =  RESHAPE( (/0.5-0.86603*j/), (/1, 1/) )
291 
292  Irr(7)%name = "Tu"
293  Irr(7)%dim = 3
294  Irr(7)%nsym = 24
295  ABI_MALLOC(Irr(7)%mat, (3,3,24))
296  Irr(7)%mat(:,:,1) =  RESHAPE( (/1.0, 0.0, 0.0, 0.0, 1.0, 0.0, 0.0, 0.0, 1.0/), (/3, 3/) )
297  Irr(7)%mat(:,:,2) =  RESHAPE( (/1.0, 0.0, 0.0, 0.0, -1.0, 0.0, 0.0, 0.0, -1.0/), (/3, 3/) )
298  Irr(7)%mat(:,:,3) =  RESHAPE( (/-1.0, 0.0, 0.0, 0.0, -1.0, 0.0, 0.0, 0.0, 1.0/), (/3, 3/) )
299  Irr(7)%mat(:,:,4) =  RESHAPE( (/-1.0, 0.0, 0.0, 0.0, 1.0, 0.0, 0.0, 0.0, -1.0/), (/3, 3/) )
300  Irr(7)%mat(:,:,5) =  RESHAPE( (/0.0, 1.0, 0.0, 0.0, 0.0, 1.0, 1.0, 0.0, 0.0/), (/3, 3/) )
301  Irr(7)%mat(:,:,6) =  RESHAPE( (/0.0, 1.0, 0.0, 0.0, 0.0, -1.0, -1.0, 0.0, 0.0/), (/3, 3/) )
302  Irr(7)%mat(:,:,7) =  RESHAPE( (/0.0, -1.0, 0.0, 0.0, 0.0, -1.0, 1.0, 0.0, 0.0/), (/3, 3/) )
303  Irr(7)%mat(:,:,8) =  RESHAPE( (/0.0, -1.0, 0.0, 0.0, 0.0, 1.0, -1.0, 0.0, 0.0/), (/3, 3/) )
304  Irr(7)%mat(:,:,9) =  RESHAPE( (/0.0, 0.0, 1.0, 1.0, 0.0, 0.0, 0.0, 1.0, 0.0/), (/3, 3/) )
305  Irr(7)%mat(:,:,10) =  RESHAPE( (/0.0, 0.0, 1.0, -1.0, 0.0, 0.0, 0.0, -1.0, 0.0/), (/3, 3/) )
306  Irr(7)%mat(:,:,11) =  RESHAPE( (/0.0, 0.0, -1.0, -1.0, 0.0, 0.0, 0.0, 1.0, 0.0/), (/3, 3/) )
307  Irr(7)%mat(:,:,12) =  RESHAPE( (/0.0, 0.0, -1.0, 1.0, 0.0, 0.0, 0.0, -1.0, 0.0/), (/3, 3/) )
308  Irr(7)%mat(:,:,13) =  RESHAPE( (/-1.0, 0.0, 0.0, 0.0, -1.0, 0.0, 0.0, 0.0, -1.0/), (/3, 3/) )
309  Irr(7)%mat(:,:,14) =  RESHAPE( (/-1.0, 0.0, 0.0, 0.0, 1.0, 0.0, 0.0, 0.0, 1.0/), (/3, 3/) )
310  Irr(7)%mat(:,:,15) =  RESHAPE( (/1.0, 0.0, 0.0, 0.0, 1.0, 0.0, 0.0, 0.0, -1.0/), (/3, 3/) )
311  Irr(7)%mat(:,:,16) =  RESHAPE( (/1.0, 0.0, 0.0, 0.0, -1.0, 0.0, 0.0, 0.0, 1.0/), (/3, 3/) )
312  Irr(7)%mat(:,:,17) =  RESHAPE( (/0.0, -1.0, 0.0, 0.0, 0.0, -1.0, -1.0, 0.0, 0.0/), (/3, 3/) )
313  Irr(7)%mat(:,:,18) =  RESHAPE( (/0.0, -1.0, 0.0, 0.0, 0.0, 1.0, 1.0, 0.0, 0.0/), (/3, 3/) )
314  Irr(7)%mat(:,:,19) =  RESHAPE( (/0.0, 1.0, 0.0, 0.0, 0.0, 1.0, -1.0, 0.0, 0.0/), (/3, 3/) )
315  Irr(7)%mat(:,:,20) =  RESHAPE( (/0.0, 1.0, 0.0, 0.0, 0.0, -1.0, 1.0, 0.0, 0.0/), (/3, 3/) )
316  Irr(7)%mat(:,:,21) =  RESHAPE( (/0.0, 0.0, -1.0, -1.0, 0.0, 0.0, 0.0, -1.0, 0.0/), (/3, 3/) )
317  Irr(7)%mat(:,:,22) =  RESHAPE( (/0.0, 0.0, -1.0, 1.0, 0.0, 0.0, 0.0, 1.0, 0.0/), (/3, 3/) )
318  Irr(7)%mat(:,:,23) =  RESHAPE( (/0.0, 0.0, 1.0, 1.0, 0.0, 0.0, 0.0, -1.0, 0.0/), (/3, 3/) )
319  Irr(7)%mat(:,:,24) =  RESHAPE( (/0.0, 0.0, 1.0, -1.0, 0.0, 0.0, 0.0, 1.0, 0.0/), (/3, 3/) )
320 
321  Irr(8)%name = "Tg"
322  Irr(8)%dim = 3
323  Irr(8)%nsym = 24
324  ABI_MALLOC(Irr(8)%mat, (3,3,24))
325  Irr(8)%mat(:,:,1) =  RESHAPE( (/1.0, 0.0, 0.0, 0.0, 1.0, 0.0, 0.0, 0.0, 1.0/), (/3, 3/) )
326  Irr(8)%mat(:,:,2) =  RESHAPE( (/1.0, 0.0, 0.0, 0.0, -1.0, 0.0, 0.0, 0.0, -1.0/), (/3, 3/) )
327  Irr(8)%mat(:,:,3) =  RESHAPE( (/-1.0, 0.0, 0.0, 0.0, -1.0, 0.0, 0.0, 0.0, 1.0/), (/3, 3/) )
328  Irr(8)%mat(:,:,4) =  RESHAPE( (/-1.0, 0.0, 0.0, 0.0, 1.0, 0.0, 0.0, 0.0, -1.0/), (/3, 3/) )
329  Irr(8)%mat(:,:,5) =  RESHAPE( (/0.0, 1.0, 0.0, 0.0, 0.0, 1.0, 1.0, 0.0, 0.0/), (/3, 3/) )
330  Irr(8)%mat(:,:,6) =  RESHAPE( (/0.0, 1.0, 0.0, 0.0, 0.0, -1.0, -1.0, 0.0, 0.0/), (/3, 3/) )
331  Irr(8)%mat(:,:,7) =  RESHAPE( (/0.0, -1.0, 0.0, 0.0, 0.0, -1.0, 1.0, 0.0, 0.0/), (/3, 3/) )
332  Irr(8)%mat(:,:,8) =  RESHAPE( (/0.0, -1.0, 0.0, 0.0, 0.0, 1.0, -1.0, 0.0, 0.0/), (/3, 3/) )
333  Irr(8)%mat(:,:,9) =  RESHAPE( (/0.0, 0.0, 1.0, 1.0, 0.0, 0.0, 0.0, 1.0, 0.0/), (/3, 3/) )
334  Irr(8)%mat(:,:,10) =  RESHAPE( (/0.0, 0.0, 1.0, -1.0, 0.0, 0.0, 0.0, -1.0, 0.0/), (/3, 3/) )
335  Irr(8)%mat(:,:,11) =  RESHAPE( (/0.0, 0.0, -1.0, -1.0, 0.0, 0.0, 0.0, 1.0, 0.0/), (/3, 3/) )
336  Irr(8)%mat(:,:,12) =  RESHAPE( (/0.0, 0.0, -1.0, 1.0, 0.0, 0.0, 0.0, -1.0, 0.0/), (/3, 3/) )
337  Irr(8)%mat(:,:,13) =  RESHAPE( (/1.0, 0.0, 0.0, 0.0, 1.0, 0.0, 0.0, 0.0, 1.0/), (/3, 3/) )
338  Irr(8)%mat(:,:,14) =  RESHAPE( (/1.0, 0.0, 0.0, 0.0, -1.0, 0.0, 0.0, 0.0, -1.0/), (/3, 3/) )
339  Irr(8)%mat(:,:,15) =  RESHAPE( (/-1.0, 0.0, 0.0, 0.0, -1.0, 0.0, 0.0, 0.0, 1.0/), (/3, 3/) )
340  Irr(8)%mat(:,:,16) =  RESHAPE( (/-1.0, 0.0, 0.0, 0.0, 1.0, 0.0, 0.0, 0.0, -1.0/), (/3, 3/) )
341  Irr(8)%mat(:,:,17) =  RESHAPE( (/0.0, 1.0, 0.0, 0.0, 0.0, 1.0, 1.0, 0.0, 0.0/), (/3, 3/) )
342  Irr(8)%mat(:,:,18) =  RESHAPE( (/0.0, 1.0, 0.0, 0.0, 0.0, -1.0, -1.0, 0.0, 0.0/), (/3, 3/) )
343  Irr(8)%mat(:,:,19) =  RESHAPE( (/0.0, -1.0, 0.0, 0.0, 0.0, -1.0, 1.0, 0.0, 0.0/), (/3, 3/) )
344  Irr(8)%mat(:,:,20) =  RESHAPE( (/0.0, -1.0, 0.0, 0.0, 0.0, 1.0, -1.0, 0.0, 0.0/), (/3, 3/) )
345  Irr(8)%mat(:,:,21) =  RESHAPE( (/0.0, 0.0, 1.0, 1.0, 0.0, 0.0, 0.0, 1.0, 0.0/), (/3, 3/) )
346  Irr(8)%mat(:,:,22) =  RESHAPE( (/0.0, 0.0, 1.0, -1.0, 0.0, 0.0, 0.0, -1.0, 0.0/), (/3, 3/) )
347  Irr(8)%mat(:,:,23) =  RESHAPE( (/0.0, 0.0, -1.0, -1.0, 0.0, 0.0, 0.0, 1.0, 0.0/), (/3, 3/) )
348  Irr(8)%mat(:,:,24) =  RESHAPE( (/0.0, 0.0, -1.0, 1.0, 0.0, 0.0, 0.0, -1.0, 0.0/), (/3, 3/) )
349 
350  RETURN
351   if (.FALSE.) write(std_out,*) j
352  end subroutine ptg_Th