Compositional tuning of ultrathin surface oxides on metal and alloy substrates using photons: Dynamic simulations and experiments

被引:12
作者
Chang, Chia-Lin [1 ]
Sankaranarayanan, Subramanian K. R. S. [1 ]
Ruzmetov, Dmitry [1 ]
Engelhard, Mark H. [2 ]
Kaxiras, Efthimios [1 ,3 ]
Ramanathan, Shriram [1 ]
机构
[1] Harvard Univ, Harvard Sch Engn & Appl Sci, Cambridge, MA 02138 USA
[2] Pacific NW Natl Lab, WR Wiley Environm Mol Sci Lab, Richland, WA 99352 USA
[3] Harvard Univ, Dept Phys, Cambridge, MA 02138 USA
基金
美国国家科学基金会;
关键词
LOSS FINE-STRUCTURE; NICKEL-OXIDE; PASSIVITY BREAKDOWN; THIN-FILMS; AB-INITIO; OXIDATION; OXYGEN; SPECTROSCOPY; PHOTOELECTRON; ZIRCONIUM;
D O I
10.1103/PhysRevB.81.085406
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We report on the ability to modify the structure and composition of ultrathin oxides grown on Ni and Ni-Al alloy surfaces at room temperature utilizing photon illumination. We find that the nickel-oxide formation is enhanced in the case of oxidation under photo-excitation. The enhanced oxidation kinetics of nickel in 5% Ni-Al alloy is corroborated by experimental and simulation studies of natural and photon-assisted oxide growth on pure Ni(100) surfaces. In case of pure Ni substrates, combined x-ray photoelectron spectroscopy analysis, and atomic force microscope current mapping support the deterministic role of the structure of nickel passive-oxide films on their nanoscale corrosion resistance. Atomistic simulations involving dynamic charge transfer predict that the applied electric field overcomes the activation-energy barrier for ionic migration, leading to enhanced oxygen incorporation into the oxide, enabling us to tune the mixed-oxide composition at atomic length scales. Atomic scale control of ultrathin oxide structure and morphology in the case of pure substrates as well as compositional tuning of complex oxide in the case of alloys leads to excellent passivity as verified from potentiodynamic polarization experiments.
引用
收藏
页数:13
相关论文
共 53 条
[1]   Role of chloride ion in passivity breakdown on iron and nickel [J].
Ahn, S ;
Kwon, H ;
Macdonald, DD .
JOURNAL OF THE ELECTROCHEMICAL SOCIETY, 2005, 152 (11) :B482-B490
[2]  
Allen M. P., 2017, COMPUTER SIMULATION
[3]   Study of Ni-Al interface formation [J].
Arranz, A ;
Palacio, C .
THIN SOLID FILMS, 1998, 317 (1-2) :55-58
[4]   Interaction of Ni/Al interfaces with oxygen [J].
Arranz, A ;
Palacio, C .
LANGMUIR, 2002, 18 (05) :1695-1701
[5]   Ni 2p X-ray photoelectron spectroscopy study of nanostructured nickel oxide [J].
Biju, V. .
MATERIALS RESEARCH BULLETIN, 2007, 42 (05) :791-796
[6]   APPLICATION OF TEM EXTENDED ELECTRON-ENERGY LOSS FINE-STRUCTURE TO THE STUDY OF ALUMINUM-OXIDE FILMS [J].
BOURDILLON, AJ ;
ELMASHRI, SM ;
FORTY, AJ .
PHILOSOPHICAL MAGAZINE A-PHYSICS OF CONDENSED MATTER STRUCTURE DEFECTS AND MECHANICAL PROPERTIES, 1984, 49 (03) :341-352
[7]   Ab initio study of the interaction of chlorides with defect-free hydroxylated NiO surfaces [J].
Bouzoubaa, Asmae ;
Diawara, Boubakar ;
Maurice, Vincent ;
Minot, Christian ;
Marcus, Philippe .
CORROSION SCIENCE, 2009, 51 (04) :941-948
[8]   DISSOCIATION OF OXYGEN IN THE UPPER ATMOSPHERE [J].
BYRAM, ET ;
CHUBB, TA ;
FRIEDMAN, H .
PHYSICAL REVIEW, 1955, 98 (06) :1594-1597
[9]   THEORY OF THE OXIDATION OF METALS [J].
CABRERA, N ;
MOTT, NF .
REPORTS ON PROGRESS IN PHYSICS, 1948, 12 :163-184
[10]   OXYGEN-NICKEL BOND LENGTH IN NI(111)-P (2X2)O DETERMINED BY ELECTRON-ENERGY-LOSS FINE-STRUCTURE SPECTROSCOPY [J].
CAPUTI, LS ;
JIANG, SL ;
AMODDEO, A ;
TUCCI, R .
PHYSICAL REVIEW B, 1990, 41 (12) :8513-8515