MOLPRO Basis Query (current), basis=LANL2DZ

 Molpro basis library lanl2dz (LANL2DZ ECP)
 Generated from data/lanl2dz.bas at Mon Jul  5 16:43:48 BST 1999

  Literature Citation
Elements                             References                               
--------                             ----------                               
H  - Ne: T. H. Dunning Jr. and P. J. Hay, in Methods of Electronic Structure  
         Theory, Vol. 2, H. F. Schaefer III, ed., PLENUM PRESS (1977)         
Na - Hg: P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 270 (1985).             
         P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 284 (1985).             
         P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 299 (1985).             

 HYDROGEN     (4s) -> [2s]                                      

 LITHIUM      (10s,4p) -> [3s,2p]                               

 BERYLLIUM    (10s,5p) -> [3s,2p]                               

 BORON        (10s,5p) -> [3s,2p]                               

 CARBON       (10s,5p) -> [3s,2p]                               

 NITROGEN     (10s,5p) -> [3s,2p]                               

 OXYGEN       (10s,5p) -> [3s,2p]                               

 FLUORINE     (10s,5p) -> [3s,2p]                               

 NEON         (10s,5p) -> [3s,2p]                               

 SODIUM       (3s,3p) -> [2s,2p]                                

 MAGNESIUM    (3s,3p) -> [2s,2p]                                

 ALUMINUM     (3s,3p) -> [2s,2p]                                

 SILICON      (3s,3p) -> [2s,2p]                                

 PHOSPHORUS   (3s,3p) -> [2s,2p]                                

 SULFUR       (3s,3p) -> [2s,2p]                                

 CHLORINE     (3s,3p) -> [2s,2p]                                

 ARGON        (3s,3p) -> [2s,2p]                                

 POTASSIUM    (5s,5p) -> [3s,3p]                                

 CALCIUM      (5S,5P) -> [3S,3P]                                

 SCANDIUM     (5S,5P,5D) -> [3S,3P,2D]                          

 TITANIUM     (5S,5P,5D) -> [3S,3P,2D]                          

 VANADIUM     (5S,5P,5D) -> [3S,3P,2D]                          

 CHROMIUM     (5S,5P,5D) -> [3S,3P,2D]                          

 MANGANESE    (5S,5P,5D) -> [3S,3P,2D]                          

 IRON         (5S,5P,5D) -> [3S,3P,2D]                          

 COBALT       (5S,5P,5D) -> [3S,3P,2D]                          

 NICKEL       (5S,5P,5D) -> [3S,3P,2D]                          

 COPPER       (5S,5P,5D) -> [3S,3P,2D]                          

 ZINC         (3S,2P,5D) -> [2S,2P,2D]                          

 GALLIUM      (3S,3P) -> [2S,2P]                                

 GERMANIUM    (3S,3P) -> [2S,2P]                                

 ARSENIC      (3S,3P) -> [2S,2P]                                

 SELENIUM     (3S,3P) -> [2S,2P]                                

 BROMINE      (3S,3P) -> [2S,2P]                                

 KRYPTON      (3S,3P) -> [2S,2P]                                

 RUBIDIUM     (5S,6P) -> [3S,3P]                                

 STRONTIUM    (5S,6P) -> [3S,3P]                                

 YTTRIUM      (5S,6P,4D) -> [3S,3P,2D]                          

 ZIRCONIUM    (5S,6P,4D) -> [3S,3P,2D]                          

 NIOBIUM      (5S,6P,4D) -> [3S,3P,2D]                          

 MOLYBDENUM   (5S,6P,4D) -> [3S,3P,2D]                          

 TECHNETIUM   (5S,6P,4D) -> [3S,3P,2D]                          

 RUTHENIUM    (5S,6P,4D) -> [3S,3P,2D]                          

 RHODIUM      (5S,6P,4D) -> [3S,3P,2D]                          

 PALLADIUM    (5S,6P,4D) -> [3S,3P,2D]                          

 SILVER       (5S,6P,4D) -> [3S,3P,2D]                          

 CADMIUM      (3S,3P,4D) -> [2S,2P,2D]                          

 INDIUM       (3S,3P) -> [2S,2P]                                

 TIN          (3S,3P) -> [2S,2P]                                

 ANTIMONY     (3S,3P) -> [2S,2P]                                

 TELLERIUM    (3S,3P) -> [2S,2P]                                

 IODINE       (3S,3P) -> [2S,2P]                                

 XENON        (3S,3P) -> [2S,2P]                                

 CESIUM       (5S,6P) -> [3S,3P]                                

 BARIUM       (5S,6P) -> [3S,3P]                                

 LANTHANUM    (5S,6P,3D) -> [3S,3P,2D]                          

 HAFNIUM      (5S,6P,3D) -> [3S,3P,2D]                          

 TANTALUM     (5S,6P,3D) -> [3S,3P,2D]                          

 WOLFFRAM     (5S,6P,3D) -> [3S,3P,2D]                          

 RHENIUM      (5S,6P,3D) -> [3S,3P,2D]                          

 OSMIUM       (5S,6P,3D) -> [3S,3P,2D]                          

 IRIDIUM      (5S,6P,3D) -> [3S,3P,2D]                          

 PLATINUM     (5S,6P,3D) -> [3S,3P,2D]                          

 GOLD         (5S,6P,3D) -> [3S,3P,2D]                          

 URANIUM      (6S,5P,2D,2F) -> [3S,3P,2D,2F]                    

 NEPTUNIUM    (6S,5P,2D,2F) -> [3S,3P,2D,2F]                    

 PLUTONIUM    (7S,6P,2D,2F) -> [3S,3P,2D,2F]                    
 Effective Core Potentials
 -------------------------