✦ LIBER ✦

Ab Initio Molecular Orbital Study of Electronic and Geometrical Structures of MCH 2+ Complex and its Reactivity with H 2 , Where M = Co, Rh, and Ir

✍ Scribed by Musaev, Djamaladdin G.; Morokuma, Keiji

Book ID: 126773108
Publisher: Laser Pages Publishing Ltd.
Year: 1993
Tongue: English
Weight: 917 KB
Volume: 33
Category: Article
ISSN: 0021-2148
DOI: 10.1002/ijch.199300037

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Ab initio molecular orbital study of oxi

Ab initio molecular orbital study of oxidative addition of H2 and CH4 to the RhCl(CO)(PH3)2 complex

✍ Djamaladdin G. Musaev; Keiji Morokuma 📂 Article 📅 1995 🏛 Elsevier Science 🌐 English ⚖ 991 KB

Study of 2- H -Heptafluoropropane and It

Study of 2- H -Heptafluoropropane and Its Thermal Decomposition Using UV Photoelectron Spectroscopy and ab Initio Molecular Orbital Calculations

✍ Copeland, G.; Lee, E. P. F.; Dyke, J. M.; Chow, W. K.; Mok, D. K. W.; Chau, F. T 📂 Article 📅 2010 🏛 American Chemical Society 🌐 English ⚖ 680 KB

Ab initio molecular orbital studies on t

Ab initio molecular orbital studies on the structure, energies, and photodissociation of the electronic excited states of C[sub 2]H

✍ Cui, Qiang; Morokuma, Keiji 📂 Article 📅 1998 🏛 American Institute of Physics 🌐 English ⚖ 541 KB

Ab initio molecular orbital and density

Ab initio molecular orbital and density functional study of the C6H6⋅I2 complex in the ground and excited electronic states

✍ A. M. Mebel; H. L. Lin; S. H. Lin 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 236 KB 👁 2 views

The structure and energetics of the C H и I complex have been studied 6 6 2 1 1.55 eV difference between the vertical and adiabatic excitation energies of 4 AЈ and the dramatic geometry change in the CT state.

Preparation, reactivity, hydroformylatio

Preparation, reactivity, hydroformylation catalysis, and structural studies of the early transition metal/late transition metal heterobimetallic complexes Cp2M(.mu.-PR2)2M'H(CO)PPh3 (M = Zr, Hf; M' = Rh, Ir)

✍ Gelmini, Lucio.; Stephan, Douglas W. 📂 Article 📅 1988 🏛 American Chemical Society 🌐 English ⚖ 900 KB

An ab initio study of the structures and

An ab initio study of the structures and stabilities of the complexes of the bases N2O, CO2, and CO with the acids FH, H+, and Li+

✍ Janet E. Del Bene; Michael J. Frisch 📂 Article 📅 2009 🏛 John Wiley and Sons 🌐 English ⚖ 476 KB