ChemVizLab Activities |
Basis Set Reference Periodic Table: | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Geometry Optimization Lab Activity Basis Set Reference Periodic Table Cartesian Converter Materials Readings Lab Activities Support Materials Related Links Developers' Tools
|
H:
Default HDZV
He:
Default HeDZVP
Li:
Default Li.strang
Be:
Default Be321G
B:
Default BDZ
C:
Default CDZ
N:
Default NDZ
O:
Default ODZ
F:
Default FDZ
Ne:
Default Ne5S4P
Na:
Default NaMINI4++
Mg:
Default Mg321G
Al:
Default AlDZ
Si:
Default SiDZ
P:
Default PDZ
S:
Default SDZ
Cl:
Default ClDZ
Ar:
Default ArSTO3G
K:
Default KDZVP
Ca:
Default Ca
Sc:
Default ScDZVP
Ti:
Default TiK
V:
Default VHK
Cr:
Default CrJimH
Mn:
Default MnDZVP
Fe:
Default Fe1
Co:
Default Co1
Ni:
Default Ni1
Cu:
Default Cu1
Zn:
Default Zn3
Ga:
Default GaDZVP
Ge:
Default GeDZVP
As:
Default AsDZVP
Se:
Default SeDZVP
Br:
Default BrSTO3G
Kr:
Default KrDZVP
Rb:
Default RbDZVP
Sr:
Default SrDZVP
Y:
Default YDZVP
Zr:
Default ZrDZVP
Nb:
Default NbHK
Mo:
Default MoDZVP
Tc:
Default TcDZVP
Ru:
Default RuDZVP
Rh:
Default RhDZVP
Pd:
Default Pd1S0
Ag:
Default AgRECP312
Cd:
Default CdDZVP
In:
Default InDZVP
Sn:
Default SnDZVP
Sb:
Default SbDZVP
Te:
Default TeDZVP
I:
Default IDZVP
Xe:
Default XeDZVP
Hf:
Default Hf
Pt:
Default Pt3dRECPs
Au:
Default Au1eRECP
Hg:
Default Hg2eRECPb
Ho:
Default Horb
U:
Default ULF
|
The Shodor
Education Foundation, Inc.in cooperation with the
National Center for Supercomputing Applications
© Copyright 1999-2000 The Shodor Education Foundation, Inc.