How many hydrogen atoms can be bound to a metal?: Predicted MH12 species

被引：79

作者：

Gagliardi, L ^{[1
]}

Pyykkö, P

机构：

[1] Univ Palermo, Dept Phys Chem F Accascina, I-90128 Palermo, Italy

[2] Univ Helsinki, Dept Chem, FIN-00014 Helsinki, Finland

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 2004年 / 126卷 / 46期

关键词：

D O I：

10.1021/ja045991l

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

Quantum chemical calculations predict the existence of new molecular species with general formula MH12, where M is a group 6 atom. The previous MHn species had n values up to 9. The new systems with n = 12 would be a new record for metal hydrides. Copyright © 2004 American Chemical Society.

引用

页码：15014 / 15015

页数：2

共 20 条

[1] 2ND-ORDER PERTURBATION-THEORY WITH A COMPLETE ACTIVE SPACE SELF-CONSISTENT FIELD REFERENCE FUNCTION
ANDERSSON, K
MALMQVIST, PA
ROOS, BO
[J]. JOURNAL OF CHEMICAL PHYSICS, 1992, 96 (02) : 1218 - 1226
[2] ANDERSSON K, 2003, MOLCAS VERS 6 0
[3] ENERGY-ADJUSTED ABINITIO PSEUDOPOTENTIALS FOR THE 2ND AND 3RD ROW TRANSITION-ELEMENTS
ANDRAE, D
HAUSSERMANN, U
DOLG, M
STOLL, H
PREUSS, H
[J]. THEORETICA CHIMICA ACTA, 1990, 77 (02): : 123 - 141
[4] Properties of WAu12
Autschbach, J
Hess, BA
Johansson, MP
Neugebauer, J
Patzschke, M
Pyykkö, P
Reiher, M
Sundholm, D
[J]. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2004, 6 (01) : 11 - 22
[5] Future directions in solid state chemistry: report of the NSF-sponsored workshop
Cava, RJ
DiSalvo, FJ
Brus, LE
Dunbar, KR
Gorman, CB
Haile, SM
Interrante, LV
Musfeldt, JL
Navrotsky, A
Nuzzo, RG
Pickett, WE
Wilkinson, AP
Ahn, C
Allen, JW
Burns, PC
Ceder, G
Chidsey, CED
Clegg, W
Coronado, E
Dai, HJ
Deem, MW
Dunn, BS
Galli, G
Jacobson, AJ
Kanatzidis, M
Lin, WB
Manthiram, A
Mrksich, M
Norris, DJ
Nozik, AJ
Peng, XG
Rawn, C
Rolison, D
Singh, DJ
Toby, BH
Tolbert, S
Wiesner, UB
Woodward, PM
Yang, PD
[J]. PROGRESS IN SOLID STATE CHEMISTRY, 2002, 30 (1-2) : 1 - 101
[6] Study of the MAu6 (M = Cr, Mo, W) molecular species:: A transition from halogenlike to hydrogenlike chemical behavior for gold
Gagliardi, L
Pyykkö, P
[J]. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2004, 6 (11) : 2904 - 2906
[7] Thermal decomposition of the non-interstitial hydrides for the storage and production of hydrogen
Grochala, W
Edwards, PP
[J]. CHEMICAL REVIEWS, 2004, 104 (03) : 1283 - 1315
[8] [SiAu4]:: Aurosilane
Kiran, B
Li, X
Zhai, HJ
Cui, LF
Wang, LS
[J]. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2004, 43 (16) : 2125 - 2129
[9] KUBAS GJ, 1999, METAL DIHYDROGEN SIG
[10] SYNTHESIS AND STRUCTURE OF [FECO3(CO)12AUPPH3 - A TRIMETALLIC TRIGONAL-BIPYRAMIDAL CLUSTER - GOLD DERIVATIVES AS STRUCTURAL ANALOGS OF HYDRIDES
LAUHER, JW
WALD, K
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1981, 103 (25) : 7648 - 7650

← 1 2 →