Density Function Theoretical Investigation on the Ni3PP Structure and the Hydrogen Adsorption Property of the Ni2P(0001) Surface

Autor:	Hiroko Ariga, Mayumi Kawashima, Satoru Takakusagi, Kiyotaka Asakura
Rok vydání:	2013
Předmět:	Surface (mathematics) Chemistry Phosphorus adsorption Structure (category theory) Thermodynamics Probability density function Density functional theory General Chemistry Hydrogen adsorption
Zdroj:	Chemistry Letters. 42:1481-1483
ISSN:	1348-0715 0366-7022
DOI:	10.1246/cl.130710
Popis:	The electronic and structural properties of a phosphorus-terminated structure of Ni2P(0001) surface (Ni3PP) are investigated by density functional theory (DFT) calculations. Phosphorus adsorption l...
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::e96a93540c83d60861ea4cb4c1d95c73 https://doi.org/10.1246/cl.130710 Zobrazit plný text záznamu