Published September 1, 2013
| Version v1
Journal article
Corrosion behavior of different tantalum crystal faces in NH4Br–ethanol solution and DFT calculation
Description
We report different corrosion mechanisms for the (1 1 0), (2 0 0) and (2 1 1) crystal faces of tantalum in NH4Br–ethanol solution. With increasing temperature, the Br-Ta bond was found to readily attract electrons from the [1 1 0] orientation atomic interlayer due to large layer spacing and weak layer-to-layer interaction, resulting in an easily corroded (1 1 0) face. On the other hand, short layer spacing and strong interactions between layers led to passivation of the (2 0 0) and (2 1 1) faces with increasing temperatures, on account of the fact that the Br-Ta bond is unable to easily draw electrons from the atomic inter-layers.
Availability note (English)
Available from http://dx.doi.org/10.1016/j.apsusc.2013.04.143Additional details
Identifiers
- DOI
- 10.1016/j.apsusc.2013.04.143;
- PII
- S0169-4332(13)00863-5;
Publishing Information
- Journal Title
- Applied Surface Science
- Journal Volume
- 280
- Journal Page Range
- p. 247-255
- ISSN
- 0169-4332
- CODEN
- ASUSEE
INIS
- Country of Publication
- Netherlands
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 46003394
- Subject category
- S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
- Descriptors DEI
- CRYSTALS; DENSITY FUNCTIONAL METHOD; DISSOLUTION; ELECTRONS; ETHANOL; LAYERS; ORIENTATION; OXIDATION; PASSIVATION; PITTING CORROSION; SIMULATION; SOLUTIONS; STRONG INTERACTIONS; SURFACES; TANTALUM; TEMPERATURE DEPENDENCE; VOLTAMETRY
- Descriptors DEC
- ALCOHOLS; BASIC INTERACTIONS; CALCULATION METHODS; CHEMICAL REACTIONS; CORROSION; DISPERSIONS; ELEMENTARY PARTICLES; ELEMENTS; FERMIONS; HOMOGENEOUS MIXTURES; HYDROXY COMPOUNDS; INTERACTIONS; LEPTONS; METALS; MIXTURES; ORGANIC COMPOUNDS; REFRACTORY METALS; TRANSITION ELEMENTS; VARIATIONAL METHODS
Optional Information
- Copyright
- Copyright (c) 2013 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved.