ROLE OF PHOSPHINE-LIGANDS IN GOLD CLUSTER CHEMISTRY - RELATIVISTIC SCF CALCULATIONS ON AU2 AND AU2(PH3)2

被引:45
作者
SCHWERDTFEGER, P
BOYD, PDW
机构
[1] UNIV AUCKLAND,CTR INFORMAT SCI,AUCKLAND,NEW ZEALAND
[2] UNIV AUCKLAND,DEPT CHEM,AUCKLAND,NEW ZEALAND
关键词
D O I
10.1021/ic00028a039
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
[No abstract available]
引用
收藏
页码:327 / 329
页数:3
相关论文
共 55 条
[1]   ENERGY-ADJUSTED ABINITIO PSEUDOPOTENTIALS FOR THE 2ND-ROW AND 3RD-ROW TRANSITION-ELEMENTS - MOLECULAR TEST FOR AG2, AU2 AND RUH, OSH [J].
ANDRAE, D ;
HAUSSERMANN, U ;
DOLG, M ;
STOLL, H ;
PREUSS, H .
THEORETICA CHIMICA ACTA, 1991, 78 (04) :247-266
[2]  
[Anonymous], 1979, MOL SPECTRA MOL STRU
[3]   BONDING IN THE OCTAHEDRAL AU62+ CLUSTER [J].
ARRATIA-PEREZ, R ;
MALLI, GL .
CHEMICAL PHYSICS LETTERS, 1986, 125 (02) :143-148
[4]   DIRAC SCATTERED-WAVE CALCULATIONS FOR AG-3(2+), AU-3(1+), AU-3(2+), AND AU-4(1+), AU-4(2+) CLUSTERS [J].
ARRATIA-PEREZ, R ;
MALLI, GL .
JOURNAL OF CHEMICAL PHYSICS, 1986, 84 (10) :5891-5897
[5]   CALCULATED ELECTRONIC-STRUCTURE OF AU-13 CLUSTERS [J].
ARRATIA-PEREZ, R ;
RAMOS, AF ;
MALLI, GL .
PHYSICAL REVIEW B, 1989, 39 (05) :3005-3009
[6]   THE IONIZATION-POTENTIALS OF AG-1-4 AND AU-1-4 AND BINDING-ENERGIES OF AG-1-4, AU-1-4, AG-1-4 AND AU-1-4+ [J].
BALASUBRAMANIAN, K ;
FENG, PY .
CHEMICAL PHYSICS LETTERS, 1989, 159 (5-6) :452-458
[7]   IS AU6 A CIRCULAR RING [J].
BALASUBRAMANIAN, K ;
LIAO, DW .
JOURNAL OF CHEMICAL PHYSICS, 1991, 94 (07) :5233-5236
[8]   CASSCF/CL CALCULATIONS OF LOW-LYING STATES AND POTENTIAL-ENERGY SURFACES OF AU3 [J].
BALASUBRAMANIAN, K ;
LIAO, MZ .
JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (10) :5587-5590
[9]   THEORETICAL-STUDY OF THE STRUCTURES AND ELECTRON-AFFINITIES OF THE DIMERS AND TRIMERS OF THE GROUP-IB METALS (CU, AG, AND AU) [J].
BAUSCHLICHER, CW ;
LANGHOFF, SR ;
PARTRIDGE, H .
JOURNAL OF CHEMICAL PHYSICS, 1989, 91 (04) :2412-2419
[10]   THEORETICAL-STUDY OF THE HOMONUCLEAR TETRAMERS AND PENTAMERS OF THE GROUP-IB METALS (CU, AG, AND AU) [J].
BAUSCHLICHER, CW ;
LANGHOFF, SR ;
PARTRIDGE, H .
JOURNAL OF CHEMICAL PHYSICS, 1990, 93 (11) :8133-8137