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
|
ergo_BASIS = \
hybrid-guess-basis \
3-21G \
3-21++G \
3-21Gs \
3-21++Gs \
4-31G \
6-311G \
6-311++G_2d,2p_ \
6-31G \
6-31Gs \
6-31Gss \
6-31+G \
6-31++G \
6-31++Gs \
6-31++Gss \
6-311++Gss \
6-311Gs \
6-311+Gs \
6-311Gss \
6-31Gfixed \
Ahlrichs-Coulomb-Fit \
AhlrichsDenFit \
Ahlrichs-pVDZ \
Ahlrichs-TZV \
AhlrichsVDZ \
Ahlrichs-VDZ \
AhlrichsVTZ \
Ahlrichs-VTZ \
Almlof-Taylor-ANO \
ano-1 \
ano-2 \
ano-3 \
ano-4 \
ano-5 \
aug-cc-pCV5Z \
aug-cc-pCVDZ \
aug-cc-pCVQZ \
aug-cc-pCVTZ \
aug-cc-pCVTZ-CTOCD-uc \
aug-cc-pV_5+d_Z \
aug-cc-pV5Z \
aug-cc-pV_6+d_Z \
aug-cc-pV6Z \
aug-cc-pV_D+d_Z \
aug-cc-pVDZ \
aug-cc-pV_Q+d_Z \
aug-cc-pVQZ \
aug-cc-pV_T+d_Z \
aug-cc-pVTZ \
aug-cc-pVTZ-J \
aug-pV7Z \
cc-pCV5Z \
cc-pCVDZ \
cc-pCVQZ \
cc-pCVTZ \
cc-pV_5+d_Z \
cc-pV5Z \
cc-pV5Zdenfit \
cc-pV5Z-DK \
cc-pV_6+d_Z \
cc-pV6Z \
cc-pV_D+d_Z \
cc-pVDZ \
cc-pVDZ-DK \
cc-pV_Q+d_Z \
cc-pVQZ \
cc-pVQZdenfit \
cc-pVQZ-DK \
cc-pV_T+d_Z \
cc-pVTZ \
cc-pVTZdenfit \
cc-pVTZ-DK \
cc-pwCV5Z \
cc-pwCVDZ \
cc-pwCVQZ \
cc-pwCVTZ \
DunningDZ \
DunningTZ \
ECP \
ECP_pseudo \
ecp-sdd-DZ \
ecp-sdd-pseudo \
GAMESS-PVTZ \
GAMESS-VTZ \
Huckel \
Huz-II \
Huz-III \
Huz-IIIsu3 \
Huz-IIsu2 \
Huz-IV \
Huz-IVsu4 \
japrtano \
McLean-Chandler-VTZ \
MIDI \
NASA-Ames-ANO \
NQvD \
pV6Z \
pV7Z \
raf-r \
RoosAugDZANO \
sad-J \
sadlej \
Sadlej-pVTZ \
Sadlej-pVTZ-J \
STO-1G \
STO-2G \
STO-3G \
STO-6G \
Turbomole-DZ \
Turbomole-DZP \
Turbomole-QZV \
Turbomole-QZVP \
Turbomole-QZVPP \
Turbomole-SV \
Turbomole-SVP \
Turbomole-TZ \
Turbomole-TZP \
Turbomole-TZV \
Turbomole-TZVP \
Turbomole-TZVPP \
Turbomole-TZVPPP \
Wachtersa+f
EXTRA_DIST = $(ergo_BASIS)
ergobasisdir =$(ERGO_DATA_PREFIX)/basis
ergobasis_DATA = $(ergo_BASIS)
|
