Branch data Line data Source code
1 : : !!****f* ABINIT/ptg_D4h
2 : : !!
3 : : !! NAME
4 : : !! ptg_D4h
5 : : !!
6 : : !! FUNCTION
7 : : !!
8 : : !! COPYRIGHT
9 : : !! Copyright (C) 2010-2026 ABINIT group (MG)
10 : : !! This file is distributed under the terms of the
11 : : !! GNU General Public License, see ~abinit/COPYING
12 : : !! or http://www.gnu.org/copyleft/gpl.txt .
13 : : !! For the initials of contributors, see ~abinit/doc/developers/contributors.txt .
14 : : !!
15 : : !! INPUTS
16 : : !!
17 : : !! OUTPUT
18 : : !!
19 : : !! SOURCE
20 : : !!
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 D4h (4/mmm)
27 : :
28 : : #if defined HAVE_CONFIG_H
29 : : #include "config.h"
30 : : #endif
31 : :
32 : : #include "abi_common.h"
33 : :
34 : : module m_ptg_D4h
35 : :
36 : : #ifdef FC_INTEL
37 : : !DEC$ NOOPTIMIZE
38 : : #endif
39 : :
40 : : contains
41 : : !!**
42 : :
43 : 0 : subroutine ptg_D4h (nsym,nclass,sym,class_ids,class_names,Irr)
44 : : use defs_basis
45 : : use m_abicore
46 : : use m_defs_ptgroups, only : irrep_t
47 : : implicit none
48 : : !Arguments ------------------------------------
49 : : integer,intent(out) :: nclass,nsym
50 : : !arrays
51 : : integer,allocatable,intent(out) :: sym(:,:,:), class_ids(:,:)
52 : : character(len=5),allocatable,intent(out) :: class_names(:)
53 : : type(irrep_t),allocatable,intent(out) :: Irr(:)
54 : : !Local variables-------------------------------
55 : : complex(dp) :: j=(0.0_dp,1.0_dp)
56 : : ! ********************************************************************************
57 : : ! List of symmetries packed in classes
58 : 0 : nsym = 16
59 [ # # # # : 0 : ABI_MALLOC(sym, (3,3,nsym))
# # # # #
# # # #
# ]
60 [ # # # # ]: 0 : sym(:,:,1) = RESHAPE( (/1, 0, 0, 0, 1, 0, 0, 0, 1/) ,(/3,3/) )
61 [ # # # # ]: 0 : sym(:,:,2) = RESHAPE( (/-1, 0, 0, 0, -1, 0, 0, 0, 1/) ,(/3,3/) )
62 [ # # # # ]: 0 : sym(:,:,3) = RESHAPE( (/0, 1, 0, -1, 0, 0, 0, 0, 1/) ,(/3,3/) )
63 [ # # # # ]: 0 : sym(:,:,4) = RESHAPE( (/0, -1, 0, 1, 0, 0, 0, 0, 1/) ,(/3,3/) )
64 [ # # # # ]: 0 : sym(:,:,5) = RESHAPE( (/-1, 0, 0, 0, 1, 0, 0, 0, -1/) ,(/3,3/) )
65 [ # # # # ]: 0 : sym(:,:,6) = RESHAPE( (/1, 0, 0, 0, -1, 0, 0, 0, -1/) ,(/3,3/) )
66 [ # # # # ]: 0 : sym(:,:,7) = RESHAPE( (/0, 1, 0, 1, 0, 0, 0, 0, -1/) ,(/3,3/) )
67 [ # # # # ]: 0 : sym(:,:,8) = RESHAPE( (/0, -1, 0, -1, 0, 0, 0, 0, -1/) ,(/3,3/) )
68 [ # # # # ]: 0 : sym(:,:,9) = RESHAPE( (/-1, 0, 0, 0, -1, 0, 0, 0, -1/) ,(/3,3/) )
69 [ # # # # ]: 0 : sym(:,:,10) = RESHAPE( (/1, 0, 0, 0, 1, 0, 0, 0, -1/) ,(/3,3/) )
70 [ # # # # ]: 0 : sym(:,:,11) = RESHAPE( (/0, -1, 0, 1, 0, 0, 0, 0, -1/) ,(/3,3/) )
71 [ # # # # ]: 0 : sym(:,:,12) = RESHAPE( (/0, 1, 0, -1, 0, 0, 0, 0, -1/) ,(/3,3/) )
72 [ # # # # ]: 0 : sym(:,:,13) = RESHAPE( (/1, 0, 0, 0, -1, 0, 0, 0, 1/) ,(/3,3/) )
73 [ # # # # ]: 0 : sym(:,:,14) = RESHAPE( (/-1, 0, 0, 0, 1, 0, 0, 0, 1/) ,(/3,3/) )
74 [ # # # # ]: 0 : sym(:,:,15) = RESHAPE( (/0, -1, 0, -1, 0, 0, 0, 0, 1/) ,(/3,3/) )
75 [ # # # # ]: 0 : sym(:,:,16) = RESHAPE( (/0, 1, 0, 1, 0, 0, 0, 0, 1/) ,(/3,3/) )
76 : :
77 : : ! Number of classes and corresponding indices
78 : 0 : nclass = 10
79 [ # # # # : 0 : ABI_MALLOC(class_ids, (2,nclass))
# # # # #
# # # #
# ]
80 : 0 : class_ids(1,1) = 1
81 : 0 : class_ids(2,1) = 1
82 : 0 : class_ids(1,2) = 2
83 : 0 : class_ids(2,2) = 2
84 : 0 : class_ids(1,3) = 3
85 : 0 : class_ids(2,3) = 4
86 : 0 : class_ids(1,4) = 5
87 : 0 : class_ids(2,4) = 6
88 : 0 : class_ids(1,5) = 7
89 : 0 : class_ids(2,5) = 8
90 : 0 : class_ids(1,6) = 9
91 : 0 : class_ids(2,6) = 9
92 : 0 : class_ids(1,7) = 10
93 : 0 : class_ids(2,7) = 10
94 : 0 : class_ids(1,8) = 11
95 : 0 : class_ids(2,8) = 12
96 : 0 : class_ids(1,9) = 13
97 : 0 : class_ids(2,9) = 14
98 : 0 : class_ids(1,10) = 15
99 : 0 : class_ids(2,10) = 16
100 : :
101 [ # # # # : 0 : ABI_MALLOC(class_names,(10))
# # ]
102 : 0 : class_names(1) = "1+"
103 : 0 : class_names(2) = "2+"
104 : 0 : class_names(3) = "4+"
105 : 0 : class_names(4) = "2+"
106 : 0 : class_names(5) = "2+"
107 : 0 : class_names(6) = "-2-"
108 : 0 : class_names(7) = "-2+"
109 : 0 : class_names(8) = "-4+"
110 : 0 : class_names(9) = "-2+"
111 : 0 : class_names(10) = "-2+"
112 : :
113 : : ! List of irreducible representations.
114 [ # # # # : 0 : ABI_MALLOC(Irr, (10))
# # # # #
# # # #
# ]
115 : 0 : Irr(1)%name = "A1g"
116 : 0 : Irr(1)%dim = 1
117 : 0 : Irr(1)%nsym = 16
118 [ # # # # : 0 : ABI_MALLOC(Irr(1)%mat, (1,1,16))
# # ]
119 [ # # # # ]: 0 : Irr(1)%mat(:,:,1) = RESHAPE( (/1.0/), (/1, 1/) )
120 [ # # # # ]: 0 : Irr(1)%mat(:,:,2) = RESHAPE( (/1.0/), (/1, 1/) )
121 [ # # # # ]: 0 : Irr(1)%mat(:,:,3) = RESHAPE( (/1.0/), (/1, 1/) )
122 [ # # # # ]: 0 : Irr(1)%mat(:,:,4) = RESHAPE( (/1.0/), (/1, 1/) )
123 [ # # # # ]: 0 : Irr(1)%mat(:,:,5) = RESHAPE( (/1.0/), (/1, 1/) )
124 [ # # # # ]: 0 : Irr(1)%mat(:,:,6) = RESHAPE( (/1.0/), (/1, 1/) )
125 [ # # # # ]: 0 : Irr(1)%mat(:,:,7) = RESHAPE( (/1.0/), (/1, 1/) )
126 [ # # # # ]: 0 : Irr(1)%mat(:,:,8) = RESHAPE( (/1.0/), (/1, 1/) )
127 [ # # # # ]: 0 : Irr(1)%mat(:,:,9) = RESHAPE( (/1.0/), (/1, 1/) )
128 [ # # # # ]: 0 : Irr(1)%mat(:,:,10) = RESHAPE( (/1.0/), (/1, 1/) )
129 [ # # # # ]: 0 : Irr(1)%mat(:,:,11) = RESHAPE( (/1.0/), (/1, 1/) )
130 [ # # # # ]: 0 : Irr(1)%mat(:,:,12) = RESHAPE( (/1.0/), (/1, 1/) )
131 [ # # # # ]: 0 : Irr(1)%mat(:,:,13) = RESHAPE( (/1.0/), (/1, 1/) )
132 [ # # # # ]: 0 : Irr(1)%mat(:,:,14) = RESHAPE( (/1.0/), (/1, 1/) )
133 [ # # # # ]: 0 : Irr(1)%mat(:,:,15) = RESHAPE( (/1.0/), (/1, 1/) )
134 [ # # # # ]: 0 : Irr(1)%mat(:,:,16) = RESHAPE( (/1.0/), (/1, 1/) )
135 : :
136 : 0 : Irr(2)%name = "A1u"
137 : 0 : Irr(2)%dim = 1
138 : 0 : Irr(2)%nsym = 16
139 [ # # # # : 0 : ABI_MALLOC(Irr(2)%mat, (1,1,16))
# # ]
140 [ # # # # ]: 0 : Irr(2)%mat(:,:,1) = RESHAPE( (/1.0/), (/1, 1/) )
141 [ # # # # ]: 0 : Irr(2)%mat(:,:,2) = RESHAPE( (/1.0/), (/1, 1/) )
142 [ # # # # ]: 0 : Irr(2)%mat(:,:,3) = RESHAPE( (/1.0/), (/1, 1/) )
143 [ # # # # ]: 0 : Irr(2)%mat(:,:,4) = RESHAPE( (/1.0/), (/1, 1/) )
144 [ # # # # ]: 0 : Irr(2)%mat(:,:,5) = RESHAPE( (/1.0/), (/1, 1/) )
145 [ # # # # ]: 0 : Irr(2)%mat(:,:,6) = RESHAPE( (/1.0/), (/1, 1/) )
146 [ # # # # ]: 0 : Irr(2)%mat(:,:,7) = RESHAPE( (/1.0/), (/1, 1/) )
147 [ # # # # ]: 0 : Irr(2)%mat(:,:,8) = RESHAPE( (/1.0/), (/1, 1/) )
148 [ # # # # ]: 0 : Irr(2)%mat(:,:,9) = RESHAPE( (/-1.0/), (/1, 1/) )
149 [ # # # # ]: 0 : Irr(2)%mat(:,:,10) = RESHAPE( (/-1.0/), (/1, 1/) )
150 [ # # # # ]: 0 : Irr(2)%mat(:,:,11) = RESHAPE( (/-1.0/), (/1, 1/) )
151 [ # # # # ]: 0 : Irr(2)%mat(:,:,12) = RESHAPE( (/-1.0/), (/1, 1/) )
152 [ # # # # ]: 0 : Irr(2)%mat(:,:,13) = RESHAPE( (/-1.0/), (/1, 1/) )
153 [ # # # # ]: 0 : Irr(2)%mat(:,:,14) = RESHAPE( (/-1.0/), (/1, 1/) )
154 [ # # # # ]: 0 : Irr(2)%mat(:,:,15) = RESHAPE( (/-1.0/), (/1, 1/) )
155 [ # # # # ]: 0 : Irr(2)%mat(:,:,16) = RESHAPE( (/-1.0/), (/1, 1/) )
156 : :
157 : 0 : Irr(3)%name = "A2g"
158 : 0 : Irr(3)%dim = 1
159 : 0 : Irr(3)%nsym = 16
160 [ # # # # : 0 : ABI_MALLOC(Irr(3)%mat, (1,1,16))
# # ]
161 [ # # # # ]: 0 : Irr(3)%mat(:,:,1) = RESHAPE( (/1.0/), (/1, 1/) )
162 [ # # # # ]: 0 : Irr(3)%mat(:,:,2) = RESHAPE( (/1.0/), (/1, 1/) )
163 [ # # # # ]: 0 : Irr(3)%mat(:,:,3) = RESHAPE( (/1.0/), (/1, 1/) )
164 [ # # # # ]: 0 : Irr(3)%mat(:,:,4) = RESHAPE( (/1.0/), (/1, 1/) )
165 [ # # # # ]: 0 : Irr(3)%mat(:,:,5) = RESHAPE( (/-1.0/), (/1, 1/) )
166 [ # # # # ]: 0 : Irr(3)%mat(:,:,6) = RESHAPE( (/-1.0/), (/1, 1/) )
167 [ # # # # ]: 0 : Irr(3)%mat(:,:,7) = RESHAPE( (/-1.0/), (/1, 1/) )
168 [ # # # # ]: 0 : Irr(3)%mat(:,:,8) = RESHAPE( (/-1.0/), (/1, 1/) )
169 [ # # # # ]: 0 : Irr(3)%mat(:,:,9) = RESHAPE( (/1.0/), (/1, 1/) )
170 [ # # # # ]: 0 : Irr(3)%mat(:,:,10) = RESHAPE( (/1.0/), (/1, 1/) )
171 [ # # # # ]: 0 : Irr(3)%mat(:,:,11) = RESHAPE( (/1.0/), (/1, 1/) )
172 [ # # # # ]: 0 : Irr(3)%mat(:,:,12) = RESHAPE( (/1.0/), (/1, 1/) )
173 [ # # # # ]: 0 : Irr(3)%mat(:,:,13) = RESHAPE( (/-1.0/), (/1, 1/) )
174 [ # # # # ]: 0 : Irr(3)%mat(:,:,14) = RESHAPE( (/-1.0/), (/1, 1/) )
175 [ # # # # ]: 0 : Irr(3)%mat(:,:,15) = RESHAPE( (/-1.0/), (/1, 1/) )
176 [ # # # # ]: 0 : Irr(3)%mat(:,:,16) = RESHAPE( (/-1.0/), (/1, 1/) )
177 : :
178 : 0 : Irr(4)%name = "A2u"
179 : 0 : Irr(4)%dim = 1
180 : 0 : Irr(4)%nsym = 16
181 [ # # # # : 0 : ABI_MALLOC(Irr(4)%mat, (1,1,16))
# # ]
182 [ # # # # ]: 0 : Irr(4)%mat(:,:,1) = RESHAPE( (/1.0/), (/1, 1/) )
183 [ # # # # ]: 0 : Irr(4)%mat(:,:,2) = RESHAPE( (/1.0/), (/1, 1/) )
184 [ # # # # ]: 0 : Irr(4)%mat(:,:,3) = RESHAPE( (/1.0/), (/1, 1/) )
185 [ # # # # ]: 0 : Irr(4)%mat(:,:,4) = RESHAPE( (/1.0/), (/1, 1/) )
186 [ # # # # ]: 0 : Irr(4)%mat(:,:,5) = RESHAPE( (/-1.0/), (/1, 1/) )
187 [ # # # # ]: 0 : Irr(4)%mat(:,:,6) = RESHAPE( (/-1.0/), (/1, 1/) )
188 [ # # # # ]: 0 : Irr(4)%mat(:,:,7) = RESHAPE( (/-1.0/), (/1, 1/) )
189 [ # # # # ]: 0 : Irr(4)%mat(:,:,8) = RESHAPE( (/-1.0/), (/1, 1/) )
190 [ # # # # ]: 0 : Irr(4)%mat(:,:,9) = RESHAPE( (/-1.0/), (/1, 1/) )
191 [ # # # # ]: 0 : Irr(4)%mat(:,:,10) = RESHAPE( (/-1.0/), (/1, 1/) )
192 [ # # # # ]: 0 : Irr(4)%mat(:,:,11) = RESHAPE( (/-1.0/), (/1, 1/) )
193 [ # # # # ]: 0 : Irr(4)%mat(:,:,12) = RESHAPE( (/-1.0/), (/1, 1/) )
194 [ # # # # ]: 0 : Irr(4)%mat(:,:,13) = RESHAPE( (/1.0/), (/1, 1/) )
195 [ # # # # ]: 0 : Irr(4)%mat(:,:,14) = RESHAPE( (/1.0/), (/1, 1/) )
196 [ # # # # ]: 0 : Irr(4)%mat(:,:,15) = RESHAPE( (/1.0/), (/1, 1/) )
197 [ # # # # ]: 0 : Irr(4)%mat(:,:,16) = RESHAPE( (/1.0/), (/1, 1/) )
198 : :
199 : 0 : Irr(5)%name = "B1g"
200 : 0 : Irr(5)%dim = 1
201 : 0 : Irr(5)%nsym = 16
202 [ # # # # : 0 : ABI_MALLOC(Irr(5)%mat, (1,1,16))
# # ]
203 [ # # # # ]: 0 : Irr(5)%mat(:,:,1) = RESHAPE( (/1.0/), (/1, 1/) )
204 [ # # # # ]: 0 : Irr(5)%mat(:,:,2) = RESHAPE( (/1.0/), (/1, 1/) )
205 [ # # # # ]: 0 : Irr(5)%mat(:,:,3) = RESHAPE( (/-1.0/), (/1, 1/) )
206 [ # # # # ]: 0 : Irr(5)%mat(:,:,4) = RESHAPE( (/-1.0/), (/1, 1/) )
207 [ # # # # ]: 0 : Irr(5)%mat(:,:,5) = RESHAPE( (/1.0/), (/1, 1/) )
208 [ # # # # ]: 0 : Irr(5)%mat(:,:,6) = RESHAPE( (/1.0/), (/1, 1/) )
209 [ # # # # ]: 0 : Irr(5)%mat(:,:,7) = RESHAPE( (/-1.0/), (/1, 1/) )
210 [ # # # # ]: 0 : Irr(5)%mat(:,:,8) = RESHAPE( (/-1.0/), (/1, 1/) )
211 [ # # # # ]: 0 : Irr(5)%mat(:,:,9) = RESHAPE( (/1.0/), (/1, 1/) )
212 [ # # # # ]: 0 : Irr(5)%mat(:,:,10) = RESHAPE( (/1.0/), (/1, 1/) )
213 [ # # # # ]: 0 : Irr(5)%mat(:,:,11) = RESHAPE( (/-1.0/), (/1, 1/) )
214 [ # # # # ]: 0 : Irr(5)%mat(:,:,12) = RESHAPE( (/-1.0/), (/1, 1/) )
215 [ # # # # ]: 0 : Irr(5)%mat(:,:,13) = RESHAPE( (/1.0/), (/1, 1/) )
216 [ # # # # ]: 0 : Irr(5)%mat(:,:,14) = RESHAPE( (/1.0/), (/1, 1/) )
217 [ # # # # ]: 0 : Irr(5)%mat(:,:,15) = RESHAPE( (/-1.0/), (/1, 1/) )
218 [ # # # # ]: 0 : Irr(5)%mat(:,:,16) = RESHAPE( (/-1.0/), (/1, 1/) )
219 : :
220 : 0 : Irr(6)%name = "B1u"
221 : 0 : Irr(6)%dim = 1
222 : 0 : Irr(6)%nsym = 16
223 [ # # # # : 0 : ABI_MALLOC(Irr(6)%mat, (1,1,16))
# # ]
224 [ # # # # ]: 0 : Irr(6)%mat(:,:,1) = RESHAPE( (/1.0/), (/1, 1/) )
225 [ # # # # ]: 0 : Irr(6)%mat(:,:,2) = RESHAPE( (/1.0/), (/1, 1/) )
226 [ # # # # ]: 0 : Irr(6)%mat(:,:,3) = RESHAPE( (/-1.0/), (/1, 1/) )
227 [ # # # # ]: 0 : Irr(6)%mat(:,:,4) = RESHAPE( (/-1.0/), (/1, 1/) )
228 [ # # # # ]: 0 : Irr(6)%mat(:,:,5) = RESHAPE( (/1.0/), (/1, 1/) )
229 [ # # # # ]: 0 : Irr(6)%mat(:,:,6) = RESHAPE( (/1.0/), (/1, 1/) )
230 [ # # # # ]: 0 : Irr(6)%mat(:,:,7) = RESHAPE( (/-1.0/), (/1, 1/) )
231 [ # # # # ]: 0 : Irr(6)%mat(:,:,8) = RESHAPE( (/-1.0/), (/1, 1/) )
232 [ # # # # ]: 0 : Irr(6)%mat(:,:,9) = RESHAPE( (/-1.0/), (/1, 1/) )
233 [ # # # # ]: 0 : Irr(6)%mat(:,:,10) = RESHAPE( (/-1.0/), (/1, 1/) )
234 [ # # # # ]: 0 : Irr(6)%mat(:,:,11) = RESHAPE( (/1.0/), (/1, 1/) )
235 [ # # # # ]: 0 : Irr(6)%mat(:,:,12) = RESHAPE( (/1.0/), (/1, 1/) )
236 [ # # # # ]: 0 : Irr(6)%mat(:,:,13) = RESHAPE( (/-1.0/), (/1, 1/) )
237 [ # # # # ]: 0 : Irr(6)%mat(:,:,14) = RESHAPE( (/-1.0/), (/1, 1/) )
238 [ # # # # ]: 0 : Irr(6)%mat(:,:,15) = RESHAPE( (/1.0/), (/1, 1/) )
239 [ # # # # ]: 0 : Irr(6)%mat(:,:,16) = RESHAPE( (/1.0/), (/1, 1/) )
240 : :
241 : 0 : Irr(7)%name = "B2g"
242 : 0 : Irr(7)%dim = 1
243 : 0 : Irr(7)%nsym = 16
244 [ # # # # : 0 : ABI_MALLOC(Irr(7)%mat, (1,1,16))
# # ]
245 [ # # # # ]: 0 : Irr(7)%mat(:,:,1) = RESHAPE( (/1.0/), (/1, 1/) )
246 [ # # # # ]: 0 : Irr(7)%mat(:,:,2) = RESHAPE( (/1.0/), (/1, 1/) )
247 [ # # # # ]: 0 : Irr(7)%mat(:,:,3) = RESHAPE( (/-1.0/), (/1, 1/) )
248 [ # # # # ]: 0 : Irr(7)%mat(:,:,4) = RESHAPE( (/-1.0/), (/1, 1/) )
249 [ # # # # ]: 0 : Irr(7)%mat(:,:,5) = RESHAPE( (/-1.0/), (/1, 1/) )
250 [ # # # # ]: 0 : Irr(7)%mat(:,:,6) = RESHAPE( (/-1.0/), (/1, 1/) )
251 [ # # # # ]: 0 : Irr(7)%mat(:,:,7) = RESHAPE( (/1.0/), (/1, 1/) )
252 [ # # # # ]: 0 : Irr(7)%mat(:,:,8) = RESHAPE( (/1.0/), (/1, 1/) )
253 [ # # # # ]: 0 : Irr(7)%mat(:,:,9) = RESHAPE( (/1.0/), (/1, 1/) )
254 [ # # # # ]: 0 : Irr(7)%mat(:,:,10) = RESHAPE( (/1.0/), (/1, 1/) )
255 [ # # # # ]: 0 : Irr(7)%mat(:,:,11) = RESHAPE( (/-1.0/), (/1, 1/) )
256 [ # # # # ]: 0 : Irr(7)%mat(:,:,12) = RESHAPE( (/-1.0/), (/1, 1/) )
257 [ # # # # ]: 0 : Irr(7)%mat(:,:,13) = RESHAPE( (/-1.0/), (/1, 1/) )
258 [ # # # # ]: 0 : Irr(7)%mat(:,:,14) = RESHAPE( (/-1.0/), (/1, 1/) )
259 [ # # # # ]: 0 : Irr(7)%mat(:,:,15) = RESHAPE( (/1.0/), (/1, 1/) )
260 [ # # # # ]: 0 : Irr(7)%mat(:,:,16) = RESHAPE( (/1.0/), (/1, 1/) )
261 : :
262 : 0 : Irr(8)%name = "B2u"
263 : 0 : Irr(8)%dim = 1
264 : 0 : Irr(8)%nsym = 16
265 [ # # # # : 0 : ABI_MALLOC(Irr(8)%mat, (1,1,16))
# # ]
266 [ # # # # ]: 0 : Irr(8)%mat(:,:,1) = RESHAPE( (/1.0/), (/1, 1/) )
267 [ # # # # ]: 0 : Irr(8)%mat(:,:,2) = RESHAPE( (/1.0/), (/1, 1/) )
268 [ # # # # ]: 0 : Irr(8)%mat(:,:,3) = RESHAPE( (/-1.0/), (/1, 1/) )
269 [ # # # # ]: 0 : Irr(8)%mat(:,:,4) = RESHAPE( (/-1.0/), (/1, 1/) )
270 [ # # # # ]: 0 : Irr(8)%mat(:,:,5) = RESHAPE( (/-1.0/), (/1, 1/) )
271 [ # # # # ]: 0 : Irr(8)%mat(:,:,6) = RESHAPE( (/-1.0/), (/1, 1/) )
272 [ # # # # ]: 0 : Irr(8)%mat(:,:,7) = RESHAPE( (/1.0/), (/1, 1/) )
273 [ # # # # ]: 0 : Irr(8)%mat(:,:,8) = RESHAPE( (/1.0/), (/1, 1/) )
274 [ # # # # ]: 0 : Irr(8)%mat(:,:,9) = RESHAPE( (/-1.0/), (/1, 1/) )
275 [ # # # # ]: 0 : Irr(8)%mat(:,:,10) = RESHAPE( (/-1.0/), (/1, 1/) )
276 [ # # # # ]: 0 : Irr(8)%mat(:,:,11) = RESHAPE( (/1.0/), (/1, 1/) )
277 [ # # # # ]: 0 : Irr(8)%mat(:,:,12) = RESHAPE( (/1.0/), (/1, 1/) )
278 [ # # # # ]: 0 : Irr(8)%mat(:,:,13) = RESHAPE( (/1.0/), (/1, 1/) )
279 [ # # # # ]: 0 : Irr(8)%mat(:,:,14) = RESHAPE( (/1.0/), (/1, 1/) )
280 [ # # # # ]: 0 : Irr(8)%mat(:,:,15) = RESHAPE( (/-1.0/), (/1, 1/) )
281 [ # # # # ]: 0 : Irr(8)%mat(:,:,16) = RESHAPE( (/-1.0/), (/1, 1/) )
282 : :
283 : 0 : Irr(9)%name = "Eu"
284 : 0 : Irr(9)%dim = 2
285 : 0 : Irr(9)%nsym = 16
286 [ # # # # : 0 : ABI_MALLOC(Irr(9)%mat, (2,2,16))
# # ]
287 [ # # # # ]: 0 : Irr(9)%mat(:,:,1) = RESHAPE( (/1.0, 0.0, 0.0, 1.0/), (/2, 2/) )
288 [ # # # # ]: 0 : Irr(9)%mat(:,:,2) = RESHAPE( (/-1.0, 0.0, 0.0, -1.0/), (/2, 2/) )
289 [ # # # # : 0 : Irr(9)%mat(:,:,3) = RESHAPE( (/1*j, 0*j, 0*j, -0-1*j/), (/2, 2/) )
# # ]
290 [ # # # # : 0 : Irr(9)%mat(:,:,4) = RESHAPE( (/-0-1*j, 0*j, 0*j, 1*j/), (/2, 2/) )
# # ]
291 [ # # # # ]: 0 : Irr(9)%mat(:,:,5) = RESHAPE( (/0.0, 1.0, 1.0, 0.0/), (/2, 2/) )
292 [ # # # # ]: 0 : Irr(9)%mat(:,:,6) = RESHAPE( (/0.0, -1.0, -1.0, 0.0/), (/2, 2/) )
293 [ # # # # : 0 : Irr(9)%mat(:,:,7) = RESHAPE( (/0*j, 1*j, -0-1*j, 0*j/), (/2, 2/) )
# # ]
294 [ # # # # : 0 : Irr(9)%mat(:,:,8) = RESHAPE( (/0*j, -0-1*j, 1*j, 0*j/), (/2, 2/) )
# # ]
295 [ # # # # ]: 0 : Irr(9)%mat(:,:,9) = RESHAPE( (/-1.0, 0.0, 0.0, -1.0/), (/2, 2/) )
296 [ # # # # ]: 0 : Irr(9)%mat(:,:,10) = RESHAPE( (/1.0, 0.0, 0.0, 1.0/), (/2, 2/) )
297 [ # # # # : 0 : Irr(9)%mat(:,:,11) = RESHAPE( (/-0-1*j, 0*j, 0*j, 1*j/), (/2, 2/) )
# # ]
298 [ # # # # : 0 : Irr(9)%mat(:,:,12) = RESHAPE( (/1*j, 0*j, 0*j, -0-1*j/), (/2, 2/) )
# # ]
299 [ # # # # ]: 0 : Irr(9)%mat(:,:,13) = RESHAPE( (/0.0, -1.0, -1.0, 0.0/), (/2, 2/) )
300 [ # # # # ]: 0 : Irr(9)%mat(:,:,14) = RESHAPE( (/0.0, 1.0, 1.0, 0.0/), (/2, 2/) )
301 [ # # # # : 0 : Irr(9)%mat(:,:,15) = RESHAPE( (/0*j, -0-1*j, 1*j, 0*j/), (/2, 2/) )
# # ]
302 [ # # # # : 0 : Irr(9)%mat(:,:,16) = RESHAPE( (/0*j, 1*j, -0-1*j, 0*j/), (/2, 2/) )
# # ]
303 : :
304 : 0 : Irr(10)%name = "Eg"
305 : 0 : Irr(10)%dim = 2
306 : 0 : Irr(10)%nsym = 16
307 [ # # # # : 0 : ABI_MALLOC(Irr(10)%mat, (2,2,16))
# # ]
308 [ # # # # ]: 0 : Irr(10)%mat(:,:,1) = RESHAPE( (/1.0, 0.0, 0.0, 1.0/), (/2, 2/) )
309 [ # # # # ]: 0 : Irr(10)%mat(:,:,2) = RESHAPE( (/-1.0, 0.0, 0.0, -1.0/), (/2, 2/) )
310 [ # # # # : 0 : Irr(10)%mat(:,:,3) = RESHAPE( (/1*j, 0*j, 0*j, -0-1*j/), (/2, 2/) )
# # ]
311 [ # # # # : 0 : Irr(10)%mat(:,:,4) = RESHAPE( (/-0-1*j, 0*j, 0*j, 1*j/), (/2, 2/) )
# # ]
312 [ # # # # ]: 0 : Irr(10)%mat(:,:,5) = RESHAPE( (/0.0, 1.0, 1.0, 0.0/), (/2, 2/) )
313 [ # # # # ]: 0 : Irr(10)%mat(:,:,6) = RESHAPE( (/0.0, -1.0, -1.0, 0.0/), (/2, 2/) )
314 [ # # # # : 0 : Irr(10)%mat(:,:,7) = RESHAPE( (/0*j, 1*j, -0-1*j, 0*j/), (/2, 2/) )
# # ]
315 [ # # # # : 0 : Irr(10)%mat(:,:,8) = RESHAPE( (/0*j, -0-1*j, 1*j, 0*j/), (/2, 2/) )
# # ]
316 [ # # # # ]: 0 : Irr(10)%mat(:,:,9) = RESHAPE( (/1.0, 0.0, 0.0, 1.0/), (/2, 2/) )
317 [ # # # # ]: 0 : Irr(10)%mat(:,:,10) = RESHAPE( (/-1.0, 0.0, 0.0, -1.0/), (/2, 2/) )
318 [ # # # # : 0 : Irr(10)%mat(:,:,11) = RESHAPE( (/1*j, 0*j, 0*j, -0-1*j/), (/2, 2/) )
# # ]
319 [ # # # # : 0 : Irr(10)%mat(:,:,12) = RESHAPE( (/-0-1*j, 0*j, 0*j, 1*j/), (/2, 2/) )
# # ]
320 [ # # # # ]: 0 : Irr(10)%mat(:,:,13) = RESHAPE( (/0.0, 1.0, 1.0, 0.0/), (/2, 2/) )
321 [ # # # # ]: 0 : Irr(10)%mat(:,:,14) = RESHAPE( (/0.0, -1.0, -1.0, 0.0/), (/2, 2/) )
322 [ # # # # : 0 : Irr(10)%mat(:,:,15) = RESHAPE( (/0*j, 1*j, -0-1*j, 0*j/), (/2, 2/) )
# # ]
323 [ # # # # : 0 : Irr(10)%mat(:,:,16) = RESHAPE( (/0*j, -0-1*j, 1*j, 0*j/), (/2, 2/) )
# # ]
324 : :
325 : 0 : RETURN
326 : : if (.FALSE.) write(std_out,*) j
327 : : end subroutine ptg_D4h
328 : : !!***
329 : :
330 : : end module m_ptg_D4h
331 : : !!***
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