๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

The relationship between formate adsorption energy and electronic properties: A first principles density functional theory study

โœ Scribed by HongYan Ma; GuiChang Wang; Yoshitada Morikawa; Junji Nakamura


Book ID
107348972
Publisher
SP Science China Press
Year
2009
Tongue
English
Weight
677 KB
Volume
52
Category
Article
ISSN
1674-7291

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


The relationship between adsorption ener
โœ Gui-Chang Wang; Jun Li; Xiu-Fang Xu; Rui-Fang Li; Junji Nakamura ๐Ÿ“‚ Article ๐Ÿ“… 2005 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 122 KB

## Abstract A theoretical study of CH~3~ adsorbed on the (111) surface of some transition and noble metal surfaces M (M = Cu, Ni, Rh, Pt, Pd, Ag, Au) and on the Fe(100) is presented. We find that the hollow site is preferred more than the top one for Fe, Ni, Rh, and Cu, but it is the other way for

Density functional theory studies on the
โœ Chang Kon Kim; Jongok Won; Hoon Sik Kim; Yong Soo Kang; Hong Guang Li; Chan Kyun ๐Ÿ“‚ Article ๐Ÿ“… 2001 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 189 KB

## Abstract The formation and physicochemical properties of polymer electrolytes strongly depend on the lattice energy of metal salts. An indirect but efficient way to estimate the lattice energy through the relationship between the heterolytic bond dissociation and lattice energies is proposed in

Density functional theory studies on the
โœ Chang Kon Kim; Hongok Won; Hoon Sik Kim; Yong Soo Kang; Hong Guang Li; Chan Kyun ๐Ÿ“‚ Article ๐Ÿ“… 2002 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 35 KB

Lattice energies for metallic salts calculated by density functional theory were listed in Table V along with literature data values. Unfortunately, an inappropriate comparison was made with results obtained by using the equation of Glasser and Jenkins published in J. Amer. Chem. Soc., 2000, 122, 63