Andrew Ritzmann
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Mechanistic contrasts between manganese and rhenium bipyridine electrocatalysts for the reduction of carbon dioxide
C Riplinger, MD Sampson, AM Ritzmann, CP Kubiak, EA Carter
Journal of the American Chemical Society 136 (46), 16285-16298, 2014
2472014
Ab Initio DFT+U Analysis of Oxygen Vacancy Formation and Migration in La1-xSrxFeO3-δ (x = 0, 0.25, 0.50)
AM Ritzmann, AB Muñoz-García, M Pavone, JA Keith, EA Carter
Chemistry of Materials 25 (15), 3011-3019, 2013
1402013
Quantum-mechanics-based design principles for solid oxide fuel cell cathode materials
M Pavone, AM Ritzmann, EA Carter
Energy & Environmental Science 4 (12), 4933-4937, 2011
1252011
Oxygen transport in perovskite-type solid oxide fuel cell materials: insights from quantum mechanics
AB Munoz-Garcia, AM Ritzmann, M Pavone, JA Keith, EA Carter
Accounts of chemical research 47 (11), 3340-3348, 2014
922014
Ab initio DFT+ U analysis of oxygen transport in LaCoO 3: the effect of Co 3+ magnetic states
AM Ritzmann, M Pavone, AB Muñoz-García, JA Keith, EA Carter
Journal of Materials Chemistry A 2 (21), 8060-8074, 2014
832014
First-principles study of lanthanum strontium manganite: Insights into electronic structure and oxygen vacancy formation
M Pavone, AB Munoz-Garcia, AM Ritzmann, EA Carter
The Journal of Physical Chemistry C 118 (25), 13346-13356, 2014
672014
Oxide ion transport in Sr 2 Fe 1.5 Mo 0.5 O 6− δ, a mixed ion-electron conductor: new insights from first principles modeling
AB Muñoz-García, M Pavone, AM Ritzmann, EA Carter
Physical Chemistry Chemical Physics 15 (17), 6250-6259, 2013
522013
Density functional theory+ U analysis of the electronic structure and defect chemistry of LSCF (La 0.5 Sr 0.5 Co 0.25 Fe 0.75 O 3− δ)
AM Ritzmann, JM Dieterich, EA Carter
Physical Chemistry Chemical Physics 18 (17), 12260-12269, 2016
322016
Ab initio evaluation of oxygen diffusivity in LaFeO3: the role of lanthanum vacancies
AM Ritzmann, AB Muñoz-García, M Pavone, JA Keith, EA Carter
MRS Communications 3 (3), 161-166, 2013
272013
Density functional theory investigation of the electronic structure and defect chemistry of Sr 1-x K x FeO 3
AM Ritzmann, JM Dieterich, EA Carter
MRS Communications 6 (3), 145-150, 2016
52016
Tracking the chemical evolution of iodine species using recurrent neural networks
JA Bilbrey, CO Marrero, M Sassi, AM Ritzmann, NJ Henson, M Schram
ACS omega 5 (9), 4588-4594, 2020
12020
First principles investigation of the structural and bonding properties of hydrated actinide (IV) oxalates, An (C2O4) 2· 6H2O (An= U, Pu)
KE Garrett, AM Ritzmann, FN Smith, SH Kessler, R Devanathan, ...
Computational Materials Science 153, 146-152, 2018
12018
Chemical Modeling of the Capture of Radioiodine Species
NJ Henson, MJPC Sassi, AM Ritzmann, SE Muller, AE Johnson
Pacific Northwest National Lab.(PNNL), Richland, WA (United States), 2020
2020
Consequences of 131I Transmutation in Gas Phase Radioiodine Molecules and Adsorbed on Graphite Surface
M Sassi, AM Ritzmann, NJ Henson
The Journal of Physical Chemistry C 124 (39), 21461-21466, 2020
2020
Xenon Abatement Simulations to Support the KAERI Medical Isotope Facility
DE Stephenson, CG Doll, JC Hayes, PH Humble, JI McIntyre, ...
Pacific Northwest National Lab.(PNNL), Richland, WA (United States), 2020
2020
Consequences of ¹³¹I Transmutation in Gas Phase Radioiodine Molecules and Adsorbed on Graphite Surface
M Sassi, AM Ritzmann, NJ Henson
2020
Density functional theory analysis of the adsorption and surface chemistry of inorganic iodine species on graphite
A Ritzmann, M Sassi, N Henson
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 258, 2019
2019
First principles investigation of the structural and bonding properties of hydrated actinide (IV) oxalates, An (C2O4) 2 center dot 6H2O (An= U, Pu)
K Garrett, A Ritzmann, F Smith, S Kessler, N Henson, D Abrechet
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 256, 2018
2018
FIRST PRINCIPLES INSIGHTS INTO OXYGEN TRANSPORT IN SOLID OXIDE FUEL CELL CATHODE MATERIALS BASED ON LANTHANUM STRONTIUM COBALT FERRITE
AM Ritzmann
PRINCETON UNIVERSITY, 2016
2016
Oxygen Transport in Perovskite-Type Materials for SOFCs Cathodes: What Can We Learn from Quantum Mechanics
AB Muñoz-García, M Pavone, AM Ritzmann, EA Carter
ECS Meeting Abstracts, 1031, 2014
2014
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Artiklar 1–20