Slater-Type Basis Sets

DZ fc DZ ae TZP fc TZP ae TZ2P fc TZ2P ae QZ4P ae

QZ4P ae: Quadruple zeta all electron 4 polarization functions

Optimized for ZORA calculations. Click on the element to obtain the basis set description.

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1 H
1
He
2
2 Li
3
Be
4
B
5
C
6
N
7
O
8
F
9
Ne
10
3 Na
11
Mg
12
Al
13
Si
14
P
15
S
16
Cl
17
Ar
18
4 K
19
Ca
20
Sc
21
Ti
22
V
23
Cr
24
Mn
25
Fe
26
Co
27
Ni
28
Cu
29
Zn
30
Ga
31
Ge
32
As
33
Se
34
Br
35
Kr
36
5 Rb
37
Sr
38
Y
39
Zr
40
Nb
41
Mo
42
Tc
43
Ru
44
Rh
45
Pd
46
Ag
47
Cd
48
In
49
Sn
50
Sb
51
Te
52
I
53
Xe
54
6 Cs
55
Ba
56
La-
Lu
Hf
72
Ta
73
W
74
Re
75
Os
76
Ir
77
Pt
78
Au
79
Hg
80
Tl
81
Pb
82
Bi
83
Po
84
At
85
Rn
86
7 Fr
87
Ra
88
Ac-
Lr
Rf
104
Db
105
Sg
106
Bh
107
Hs
108
Mt
109
Uun
110
Uuu
111
Uub
112
Uut
113
Uuq
114
Uup
115
Uuh
116
Uus
117
Uuo
118
Lanthanide
elements
La
57
Ce
58
Pr
59
Nd
60
Pm
61
Sm
62
Eu
63
Gd
64
Tb
65
Dy
66
Ho
67
Er
68
Tm
69
Yb
70
Lu
71
Actinide
elements
Ac
89
Th
90
Pa
91
U
92
Np
93
Pu
94
Am
95
Cm
96
Bk
97
Cf
98
Es
99
Fm
100
Md
101
No
102
Lr
103