4.0 Article

A density functional theory (DFT) study on reduced partition function ratios of oxygen species adsorbed on a Pt19 cluster and oxygen isotope effects

Related references

Note: Only part of the references are listed.
Article Geochemistry & Geophysics

Ab initio and steady-state models for uranium isotope fractionation in multi-step biotic and abiotic reduction

Ataru Sato et al.

Summary: In this study, a steady-state model was introduced to elucidate the U isotopic fractionation during the biological reduction of U(VI) to U(IV), showing that the model can be used more generally for any U multi-step reaction following the Rayleigh model. Results revealed that the U isotopic fractionation associated with the binding of U(VI) to a cytochrome or with the reduction from U(VI) to U(V) could not be achieved solely with equilibrium fractionation and must include a kinetic isotope fractionation component.

GEOCHIMICA ET COSMOCHIMICA ACTA (2021)

Article Chemistry, Physical

Isotope effects H/D in a PEFC with Pt-Ru/anode at low and high current density

A. Pozio et al.

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY (2019)

Article Chemistry, Inorganic & Nuclear

Observation of 18O/16O isotope effects at the cathode of a polymer electrolyte membrane fuel cell

Takao Oi et al.

ISOTOPES IN ENVIRONMENTAL AND HEALTH STUDIES (2019)

Review Chemistry, Physical

Modeling the oxygen reduction reaction at platinum-based catalysts: A brief review of recent developments

Jun Huang et al.

CURRENT OPINION IN ELECTROCHEMISTRY (2019)

Article Thermodynamics

Deuterium isotope separation by combined electrolysis fuel cell

Ryota Ogawa et al.

ENERGY (2018)

Article Multidisciplinary Sciences

Effect of hydrophobic cations on the oxygen reduction reaction on single-crystal platinum electrodes

Tomoaki Kumeda et al.

NATURE COMMUNICATIONS (2018)

Article Chemistry, Analytical

Infrared spectroscopy of adsorbed OH on n(111)-(100) and n(111)-(111) series of Pt electrode

Takahiro Ueno et al.

JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2017)

Article Nuclear Science & Technology

Reduced partition function ratios of hydrogen species adsorbed on platinum cluster Pt19 studied by density functional theory

Satoshi Yanase et al.

JOURNAL OF NUCLEAR SCIENCE AND TECHNOLOGY (2017)

Article Nanoscience & Nanotechnology

Oxygen reduction on a Pt(111) catalyst in HT-PEM fuel cells by density functional theory

Hong Sun et al.

AIP ADVANCES (2017)

Review Green & Sustainable Science & Technology

PEM fuel cell system control: A review

W. R. W. Daud et al.

RENEWABLE ENERGY (2017)

Article Chemistry, Physical

Novel PEFC Application for Deuterium Isotope Separation

Hisayoshi Matsushima et al.

MATERIALS (2017)

Review Chemistry, Multidisciplinary

Recent Advances in Electrocatalysts for Oxygen Reduction Reaction

Minhua Shao et al.

CHEMICAL REVIEWS (2016)

Article Electrochemistry

Study of Deuterium Isotope Separation by PEFC

Shota Shibuya et al.

JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2016)

Article Chemistry, Physical

Catalytic activity of Pt38 in the oxygen reduction reaction from first-principles simulations

Luca Sementa et al.

CATALYSIS SCIENCE & TECHNOLOGY (2016)

Article Chemistry, Physical

Density Functional Theory Calculations of H/D Isotope Effects on Polymer Electrolyte Membrane Fuel Cell Operations

Satoshi Yanase et al.

ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES (2015)

Article Chemistry, Physical

Infrared Reflection Absorption Spectroscopy of OH Adsorption on the Low Index Planes of Pt

Hiroyuki Tanaka et al.

ELECTROCATALYSIS (2015)

Article Chemistry, Multidisciplinary

A DFT study of oxygen dissociation on platinum based nanoparticles

Paul C. Jennings et al.

NANOSCALE (2014)

Article Chemistry, Multidisciplinary

New Insights into the Oxygen Reduction Reaction Mechanism on Pt(111): A Detailed Electrochemical Study

Ana M. Gomez-Marin et al.

CHEMSUSCHEM (2013)

Article Nuclear Science & Technology

Observation of H/D isotope effects on polymer electrolyte membrane fuel cell operations

Satoshi Yanase et al.

JOURNAL OF NUCLEAR SCIENCE AND TECHNOLOGY (2013)

Article Chemistry, Physical

Observation of Lithium Isotope Effects Accompanying Electrochemical Release from Lithium Cobalt Oxide

Yuta Takami et al.

ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES (2013)

Article Chemistry, Physical

DFT-Based Study on Oxygen Adsorption on Defective Graphene-Supported Pt Nanoparticles

Dong-Hee Lim et al.

JOURNAL OF PHYSICAL CHEMISTRY C (2011)

Article Chemistry, Physical

Hydrophobic platinum-polytetrafluoroethylene catalyst for hydrogen isotope separation

Feng Huang et al.

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY (2010)

Article Chemistry, Physical

Theoretical Study of Solvent Effects on the Platinum-Catalyzed Oxygen Reduction Reaction

Yao Sha et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2010)

Article Electrochemistry

Electrochemical H/D isotope effects in PEM fuel cell

Milica P. Marceta Kaninski et al.

ELECTROCHEMISTRY COMMUNICATIONS (2008)

Article Chemistry, Physical

Surface Pourbaix diagrams and oxygen reduction activity of Pt, Ag and Ni(111) surfaces studied by DFT

Heine A. Hansen et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2008)