Electronic structure of eka-lead (element 114) compared with lead

被引:64
作者
Landau, A [1 ]
Eliav, E
Ishikawa, Y
Kaldor, U
机构
[1] Tel Aviv Univ, Sch Chem, IL-69978 Tel Aviv, Israel
[2] Univ Puerto Rico, Dept Chem, Rio Piedras, PR 00931 USA
关键词
D O I
10.1063/1.1342763
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The electronic level structure of eka-lead (element 114), the synthesis of which was reported last year, is studied by the recently developed intermediate Hamiltonian Fock-space coupled-cluster method. Very large basis sets are used, with l up to 8, and 36 electron are correlated. The accuracy of the resulting transition energies is tested by applying the same method to Pb; calculated ionization potentials and excitation energies agree with experiment within a few hundredths of an eV, and similar accuracy is expected for the heavier element. Ionization potentials and excitation energies of E114 are considerably higher than for Pb, due to the relativistic stabilization of the 7s and 7p(1/2) orbitals. This indicates that eka-lead will probably be more inert and less metallic than lead. (C) 2001 American Institute of Physics.
引用
收藏
页码:2977 / 2980
页数:4
相关论文
共 42 条
[1]  
[Anonymous], LECT NOTES CHEM
[2]   MULTIPARTICLE BOUND-STATES IN QED [J].
BUCHMULLER, W ;
DIETZ, K .
ZEITSCHRIFT FUR PHYSIK C-PARTICLES AND FIELDS, 1980, 5 (01) :45-54
[3]  
Cwiok S, 1996, NUCL PHYS A, V611, P211, DOI 10.1016/S0375-9474(96)00337-5
[4]  
Desclaux J. P., 1974, Atomic Data and Nuclear Data Tables, V12, P311, DOI 10.1016/0092-640X(73)90020-X
[5]   MANY-BODY PERTURBATION-THEORY CALCULATIONS IN ATOMS WITH OPEN-SHELLS [J].
DZUBA, VA ;
FLAMBAUM, VV ;
SILVESTROV, PG ;
SUSHKOV, OP .
PHYSICAL REVIEW A, 1991, 44 (05) :2828-2831
[6]   GROUND-STATE ELECTRON CONFIGURATION OF ELEMENT-111 [J].
ELIAV, E ;
KALDOR, U ;
SCHWERDTFEGER, P ;
HESS, BA ;
ISHIKAWA, Y .
PHYSICAL REVIEW LETTERS, 1994, 73 (24) :3203-3206
[7]   GROUND-STATE ELECTRON CONFIGURATION OF RUTHERFORDIUM - ROLE OF DYNAMIC CORRELATION [J].
ELIAV, E ;
KALDOR, U ;
ISHIKAWA, Y .
PHYSICAL REVIEW LETTERS, 1995, 74 (07) :1079-1082
[8]   RELATIVISTIC COUPLED-CLUSTER METHOD - INTRASHELL EXCITATIONS IN THE F(2) SHELLS OF PR+3 AND U+4 [J].
ELIAV, E ;
KALDOR, U ;
ISHIKAWA, Y .
PHYSICAL REVIEW A, 1995, 51 (01) :225-230
[9]   TRANSITION ENERGIES OF MERCURY AND EKAMERCURY (ELEMENT-112) BY THE RELATIVISTIC COUPLED-CLUSTER METHOD [J].
ELIAV, E ;
KALDOR, U ;
ISHIKAWA, Y .
PHYSICAL REVIEW A, 1995, 52 (04) :2765-2769
[10]   Calculated energy levels of thallium and eka-thallium (element 113) [J].
Eliav, E ;
Kaldor, U ;
Ishikawa, Y ;
Seth, M ;
Pyykko, P .
PHYSICAL REVIEW A, 1996, 53 (06) :3926-3933