Ideal
STO-3G[L502]
STO-3G[total]
6-311++G(2d,2p)[L502]
6-311++G(2d,2p)[total]
1
1
1
1
1
2
1.96
1.88
2.04
2.03
4
3.65
3.28
4.04
4.00
8
6.42
5.04
7.62
7.45
16
9.64
5.88
12.54
12.06
32
12.27
6.13
16.70
15.71
Case
SpeedUp
a-pinene
C10H16
G98->
l1->l101->l202->l301-l302->l303->l401->l502->l601->
l9999
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