Prediction of the extraction energy of an atom from the surface of Fe-Cr alloys using topological descriptors

Chemometrics and Intelligent Laboratory Systems

Volumn 62, Issue 1, 2002, Pages 1-15

  Legrand, M ^a,b   Diawara, B ^a,b   Legendre, J J ^a   Marcus, P ^b  

^a PSL RESEARCH UNIVERSITY   (France)

^b CNRS   (France)

Author keywords

Corrosion; Energy of extraction; Fe Cr alloys; Passivation; Probability of dissolution; Quantum calculation; Simulation; Statistical model; Topological descriptors

Indexed keywords

ALLOY; CHROMIUM; LEAD;

ARTICLE; BINOCULAR CONVERGENCE; CALCULATION; CORROSION; DEFENSE MECHANISM; DISSOLUTION; ENERGY; EXTRACTION; PREDICTION; PRIORITY JOURNAL; QUANTUM CHEMISTRY; STATISTICAL MODEL; SURFACE PROPERTY;

EID: 0037188145     PISSN: 01697439     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0169-7439(01)00209-X     Document Type: Article

References (8)