Journal of Electroanalytical Chemistry

Journal of Electroanalytical Chemistry, Vol.607, No.1-2 Entire volume, number list

ISSN: 1572-6657 (Print)

In this Issue (22 articles)

1 - 1	Untitled Koper M
3 - 9	Density functional theory approach for improving the catalytic activity of a biomimetic model based on the Fe-only hydrogenase active site Ma YG, Balbuena PB
10 - 16	Computer simulation of electrochemical nanostructuring induced by supersaturation conditions Mariscal MM, Leiva EPM, Dassie SA
17 - 24	Simulations of processes related to H-2-O-2 PEM fuel cells Zhdanov VP
25 - 36	Requirements for the generalization of the ab initio two-state model for external electric field induced electron transfer at electrodes Migani A, Illas F
37 - 46	Direct molecular dynamics and density-functional theoretical study of the electrochemical hydrogen oxidation reaction and underpotential deposition of H on Pt(111) Ishikawa Y, Mateo JJ, Tryk DA, Cabrera CR
47 - 53	Structure-reactivity relationship for bimetallic electrodes: Pt overlayers and PtAu surface alloys on Au(111) Gohda Y, Gross A
54 - 60	Some simulation and modified Poisson-Boltzmann theory results for the contact values of an electrolyte near a charged electrode Bhuiyan LB, Outhwaite CW, Henderson D
61 - 68	New cyclic voltammetry method for examining phase transitions: Simulated results Hamad IA, Robb DT, Rikvold PA
69 - 82	CO oxidation on stepped single crystal electrodes: A dynamic Monte Carlo study Housmans THM, Hermse CGM, Koper MTM
83 - 89	Electrolysis of water on oxide surfaces Rossmeisl J, Qu ZW, Zhu H, Kroes GJ, Norskov JK
90 - 100	Four-electron reduction of O-2 over multiple Cu-I centers: Quantum theory Vayner E, Schweiger H, Anderson AB
101 - 106	Catalyzed bond-breaking electron transfer: Effect of the separation of the reactant from the electrode Santos E, Schmickler W
107 - 112	Car-Parrinello molecular dynamics in the DFT+U formalism: Structure and energetics of solvated ferrous and ferric ions Sit PHL, Cococcioni M, Marzari N
113 - 120	Redox free energies and one-electron energy levels in density functional theory based ab initio molecular dynamics VandeVondele J, Ayala R, Suipizi M, Sprik M
121 - 132	Active site model for CO adlayer electrooxidation on nanoparticle catalysts Andreaus B, Eikerling M
133 - 139	Adsorption of formic acid on Pt(111) in the presence of water Hartnig C, Grimminger J, Spohr E
140 - 146	Vibrational frequencies of CO on Pt(111) in electric field: A periodic DFT study Lozovoi AY, Alavi A
147 - 157	Self-consistent tight binding molecular dynamics study of TiO2 nanoclusters in water Erdin S, Lin Y, Halley JW, Zapol P, Redfern P, Curtiss L
158 - 166	Theoretical investigations on the potential-induced formation of Pt-oxide surfaces Jacob T
167 - 174	A first-principles analysis of the chemisorption of hydroxide on copper under electrochemical conditions: A probe of the electronic interactions that control chemisorption at the electrochemical interface Taylor CD, Kelly RG, Neurock M
175 - 183	Challenge of the discharge of a hydronium ion at a mercury electrode: Beyond the Tafel plots Nazmutdinov RR, Bronshtein MD, Wilhelin F, Kuznetsov AM