Electronic Structures Database

This database has been compiled by D.A. Papaconstantopoulos and his students. This database is not complete but is updated occasionally.


Select the structure you want to view. More structures are being generated.
The following require 1 symbol.
FCC BCC HCP DIA
The following require 2 symbols.
CU3AU FLO NACL CSCL
The following require 3 symbols.
PEROV
Enter the symbol(s) of your choice from this chart:
H                                                                   He
Li  Be                                          B   C   N   O   F   Ne
Na  Mg                                          Al  Si  P   S   Cl  Ar
K   Ca  Sc  Ti  V   Cr  Mn  Fe  Co  Ni  Cu  Zn  Ga  Ge  As  Se  Br  Kr
Rb  Sr  Y   Zr  Nb  Mo  Tc  Ru  Rh  Pd  Ag  Cd  In  Sn  Sb  Te  I   Xe
Cs  Ba  La  Hf  Ta  W   Re  Os  Ir  Pt  Au  Hg  Tl  Pb  Bi  Po  At  Rn
Symbol #1:
Symbol #2 [if needed]:
Symbol #3 [if needed]:
Select what type of information you would like to see.


Information about the Database
Terminology used in the Database
Programs in the Database


Warning: If you have used this database to download Slater-Koster parameters (sub-directory: sk_parameters) for the NaCl structure carbides, nitrides, and oxides, be cautioned that before Jan. 23, 1998, the p-on-site parameters for C, N, and O were missing.


Last updated: Jan. 11, 2000.