mirror of
https://github.com/nwchemgit/nwchem.git
synced 2026-07-28 22:25:48 -04:00
317 lines
3.9 KiB
QBasic
317 lines
3.9 KiB
QBasic
basis rn_bert spherical
|
|
rn s
|
|
55856733.190 1
|
|
rn s
|
|
14634686.600 1
|
|
rn s
|
|
4842728.2070 1
|
|
rn s
|
|
1746306.0840 1
|
|
rn s
|
|
673343.40410 1
|
|
rn s
|
|
270324.66700 1
|
|
rn s
|
|
112518.55070 1
|
|
rn s
|
|
48259.049240 1
|
|
rn s
|
|
21287.674450 1
|
|
rn s
|
|
9634.0939460 1
|
|
rn s
|
|
4466.0628860 1
|
|
rn s
|
|
2117.3603600 1
|
|
rn s
|
|
1024.1674440 1
|
|
rn s
|
|
492.26948080 1
|
|
rn s
|
|
249.30014270 1
|
|
rn s
|
|
129.30840240 1
|
|
rn s
|
|
63.977246140 1
|
|
rn s
|
|
34.043746110 1
|
|
rn s
|
|
16.080141200 1
|
|
rn s
|
|
8.6561306980 1
|
|
rn s
|
|
3.6103260680 1
|
|
rn s
|
|
1.9225163400 1
|
|
rn s
|
|
0.6665715255 1
|
|
rn s
|
|
0.3122391175 1
|
|
rn s
|
|
0.0678188433 1
|
|
rn s
|
|
0.0274633124 1
|
|
rn p
|
|
26472160.470 1
|
|
rn p
|
|
5591397.3470 1
|
|
rn p
|
|
1407648.7350 1
|
|
rn p
|
|
397635.67990 1
|
|
rn p
|
|
122880.21010 1
|
|
rn p
|
|
41013.985600 1
|
|
rn p
|
|
14720.814260 1
|
|
rn p
|
|
5677.5969400 1
|
|
rn p
|
|
2346.4090120 1
|
|
rn p
|
|
1031.3358380 1
|
|
rn p
|
|
476.57173780 1
|
|
rn p
|
|
229.01223710 1
|
|
rn p
|
|
112.12669610 1
|
|
rn p
|
|
56.791531780 1
|
|
rn p
|
|
28.987469830 1
|
|
rn p
|
|
14.369308650 1
|
|
rn p
|
|
7.3151179190 1
|
|
rn p
|
|
3.3425366410 1
|
|
rn p
|
|
1.5814249660 1
|
|
rn p
|
|
0.5705917326 1
|
|
rn p
|
|
0.2141281446 1
|
|
rn p
|
|
0.0626161847 1
|
|
rn p
|
|
0.0222671654 1
|
|
rn d
|
|
33414.958480 1
|
|
rn d
|
|
8127.9849230 1
|
|
rn d
|
|
2741.9273520 1
|
|
rn d
|
|
1103.6706680 1
|
|
rn d
|
|
495.57578190 1
|
|
rn d
|
|
239.30049130 1
|
|
rn d
|
|
121.17455590 1
|
|
rn d
|
|
63.394768420 1
|
|
rn d
|
|
33.590126070 1
|
|
rn d
|
|
17.637404130 1
|
|
rn d
|
|
9.2785789930 1
|
|
rn d
|
|
4.7641330090 1
|
|
rn d
|
|
2.3923301870 1
|
|
rn d
|
|
1.1391846110 1
|
|
rn d
|
|
0.4669173815 1
|
|
rn d
|
|
0.1730633433 1
|
|
rn d
|
|
0.0573128449 1
|
|
rn f
|
|
655.60175940 1
|
|
rn f
|
|
221.67624200 1
|
|
rn f
|
|
93.120268220 1
|
|
rn f
|
|
42.927598920 1
|
|
rn f
|
|
20.570079570 1
|
|
rn f
|
|
9.9045498080 1
|
|
rn f
|
|
4.6364345530 1
|
|
rn f
|
|
1.9350870050 1
|
|
rn f
|
|
0.7467843810 1
|
|
rn f
|
|
0.2479786405 1
|
|
rn g
|
|
1.5239915570 1
|
|
rn g
|
|
0.3745056345 1
|
|
end
|
|
|
|
basis u_bert spherical
|
|
u s
|
|
55856733.190 1
|
|
u s
|
|
14634686.600 1
|
|
u s
|
|
4842728.2070 1
|
|
u s
|
|
1746306.0840 1
|
|
u s
|
|
673343.40410 1
|
|
u s
|
|
270324.66700 1
|
|
u s
|
|
112518.55070 1
|
|
u s
|
|
48259.049240 1
|
|
u s
|
|
21287.674450 1
|
|
u s
|
|
9634.0939460 1
|
|
u s
|
|
4466.0628860 1
|
|
u s
|
|
2117.3603600 1
|
|
u s
|
|
1024.1674440 1
|
|
u s
|
|
492.26948080 1
|
|
u s
|
|
249.30014270 1
|
|
u s
|
|
129.30840240 1
|
|
u s
|
|
63.977246140 1
|
|
u s
|
|
34.043746110 1
|
|
u s
|
|
16.080141200 1
|
|
u s
|
|
8.6561306980 1
|
|
u s
|
|
3.6103260680 1
|
|
u s
|
|
1.9225163400 1
|
|
u s
|
|
0.6665715255 1
|
|
u s
|
|
0.3122391175 1
|
|
u s
|
|
0.0678188433 1
|
|
u s
|
|
0.0274633124 1
|
|
u p
|
|
26472160.470 1
|
|
u p
|
|
5591397.3470 1
|
|
u p
|
|
1407648.7350 1
|
|
u p
|
|
397635.67990 1
|
|
u p
|
|
122880.21010 1
|
|
u p
|
|
41013.985600 1
|
|
u p
|
|
14720.814260 1
|
|
u p
|
|
5677.5969400 1
|
|
u p
|
|
2346.4090120 1
|
|
u p
|
|
1031.3358380 1
|
|
u p
|
|
476.57173780 1
|
|
u p
|
|
229.01223710 1
|
|
u p
|
|
112.12669610 1
|
|
u p
|
|
56.791531780 1
|
|
u p
|
|
28.987469830 1
|
|
u p
|
|
14.369308650 1
|
|
u p
|
|
7.3151179190 1
|
|
u p
|
|
3.3425366410 1
|
|
u p
|
|
1.5814249660 1
|
|
u p
|
|
0.5705917326 1
|
|
u p
|
|
0.2141281446 1
|
|
u p
|
|
0.0626161847 1
|
|
u p
|
|
0.0222671654 1
|
|
u d
|
|
33414.958480 1
|
|
u d
|
|
8127.9849230 1
|
|
u d
|
|
2741.9273520 1
|
|
u d
|
|
1103.6706680 1
|
|
u d
|
|
495.57578190 1
|
|
u d
|
|
239.30049130 1
|
|
u d
|
|
121.17455590 1
|
|
u d
|
|
63.394768420 1
|
|
u d
|
|
33.590126070 1
|
|
u d
|
|
17.637404130 1
|
|
u d
|
|
9.2785789930 1
|
|
u d
|
|
4.7641330090 1
|
|
u d
|
|
2.3923301870 1
|
|
u d
|
|
1.1391846110 1
|
|
u d
|
|
0.4669173815 1
|
|
u d
|
|
0.1730633433 1
|
|
u d
|
|
0.0573128449 1
|
|
u f
|
|
655.60175940 1
|
|
u f
|
|
221.67624200 1
|
|
u f
|
|
93.120268220 1
|
|
u f
|
|
42.927598920 1
|
|
u f
|
|
20.570079570 1
|
|
u f
|
|
9.9045498080 1
|
|
u f
|
|
4.6364345530 1
|
|
u f
|
|
1.9350870050 1
|
|
u f
|
|
0.7467843810 1
|
|
u f
|
|
0.2479786405 1
|
|
u g
|
|
1.5239915570 1
|
|
u g
|
|
0.3745056345 1
|
|
end
|