psi4-data 1:0.3-5 / usr / share / psi / grids / cc-pVQZ-G_medium.grid

This file is indexed.

/usr/share/psi/grids/cc-pVQZ-G_medium.grid is in psi4-data 1:0.3-5.

This file is owned by root:root, with mode 0o644.

The actual contents of the file can be viewed below. 

  1
  2
  3
  4
  5
  6
  7
  8
  9
 10
 11
 12
 13
 14
 15
 16
 17
 18
 19
 20
 21
 22
 23
 24
 25
 26
 27
 28
 29
 30
 31
 32
 33
 34
 35
 36
 37
 38
 39
 40
 41
 42
 43
 44
 45
 46
 47
 48
 49
 50
 51
 52
 53
 54
 55
 56
 57
 58
 59
 60
 61
 62
 63
 64
 65
 66
 67
 68
 69
 70
 71
 72
 73
 74
 75
 76
 77
 78
 79
 80
 81
 82
 83
 84
 85
 86
 87
 88
 89
 90
 91
 92
 93
 94
 95
 96
 97
 98
 99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
!Pseudospectral medium grid for cc-pVQZ(-G)
****
H 0
  3 0.03692
  3 0.18462
  3 0.36924
  9 0.74267
 11 1.22944
 11 1.85485
  9 2.64536
  9 3.51697
  9 4.49608
  5 5.62010
  5 6.60000
  5 8.60000
  3 10.60000
****
Li 0
  3 0.07009
  3 0.17524
  3 0.52571
  5 0.87618
  9 1.48859
 11 2.13573
 17 3.09631
 17 4.46158
 11 5.99903
  9 7.59124
  5 10.03418
  3 12.54273
  3 15.67841
  3 19.59802
****
Be 0
  3 0.03226
  3 0.09678
  3 0.38713
  5 0.64522
  9 1.09621
 11 1.57276
 17 2.28014
 17 3.28553
 11 4.41772
  9 5.59022
  5 7.38922
  3 8.86706
  3 11.45329
  3 14.77844
****
C 0
  3 0.04538
  3 0.11345
  3 0.34034
  5 0.56724
  9 0.96372
  9 1.38268
 23 2.00456
 23 2.88844
 17 3.88380
 11 4.91460
 11 6.49617
  9 8.12021
  9 10.15027
  3 12.68783
  3 14.00000
****
N 0
  3 0.03978
  3 0.09946
  3 0.29837
  5 0.49729
  9 0.84487
 11 1.21217
 17 1.75736
 17 2.53223
 17 3.40484
 11 4.30852
 11 5.69505
  9 7.11881
  9 8.89852
  3 11.12315
  3 14.00000
****
O 0
  3 0.04061
  3 0.10152
  3 0.30455
  5 0.50758
  9 0.86235
 11 1.23725
 17 1.79372
 17 2.58462
 17 3.47529
 11 4.39766
 11 5.81288
  9 7.26610
  9 9.08262
  3 11.35328
  3 14.00000
****
F 0
  3 0.03891
  3 0.09726
  3 0.29179
  5 0.48631
  9 0.82623
 11 1.18541
 17 1.71857
 17 2.47635
 17 3.32970
 11 4.21344
 11 5.56937
  9 6.96171
  9 8.70214
  3 10.87767
  3 13.00000
****
Ne 0
  3 0.03891
  3 0.09726
  3 0.29179
  5 0.48631
  9 0.82623
 11 1.18541
 17 1.71857
 17 2.47635
 17 3.32970
 11 4.21344
 11 5.56937
  9 6.96171
  9 8.70214
  3 10.87767
  3 13.00000
****
Na 0
  3 0.08289
  3 0.20723
  3 0.62168
  5 1.03614
  9 1.76036
 11 2.52565
 17 3.66160
 17 5.27612
 11 7.09427
  9 8.97716
  5 11.86611
  3 14.83263
  3 18.54079
  3 23.17599
****
Si 0
  3 0.02419
  3 0.08063
  3 0.24188
  5 0.48377
  9 0.80628
 11 1.41106
 17 2.17724
 17 3.20076
 17 4.29447
 11 5.33243
 11 6.57958
  9 8.51960
  9 10.64951
  3 13.31188
  3 16.50000
****
P 0
  3 0.02508
  3 0.08360
  3 0.25081
  5 0.50163
  9 0.83605
 11 1.46315
 17 2.25762
 17 3.31891
 17 4.45301
 11 5.52927
 11 6.82247
  9 8.83411
  9 11.04264
  3 13.80329
  3 16.80000
****
S 0
  3 0.02549
  3 0.08496
  3 0.25487
  5 0.50975
  9 0.84958
 11 1.48683
 17 2.29416
 17 3.37264
 17 4.52509
 17 5.61878
 11 6.93291
 11 8.97711
  9 11.22138
  9 14.02673
  3 17.00000
****
Cl 0
  3 0.02242
  3 0.07473
  3 0.22420
  5 0.44840
  9 0.74733
 11 1.30789
 17 2.01805
 17 2.96673
 17 3.98047
 11 4.94253
 11 6.09850
  9 7.89668
  9 9.87084
  3 12.33856
  3 14.50000
****
Ar 0
  3 0.02242
  3 0.07473
  3 0.22420
  5 0.44840
  9 0.74733
 11 1.30789
 17 2.01805
 17 2.96673
 17 3.98047
 11 4.94253
 11 6.09850
  9 7.89668
  9 9.87084
  3 12.33856
  3 14.50000
****

APT Browse - Built by Thomas Orozco.