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Publications by Peter Zapol

Quasicontinuum-Like Reduction of Density Functional Theory Calculations of Nanostructures

Journal of Nanoscience and Nanotechnology
Materials ScienceCondensed Matter PhysicsNanoscienceBioengineeringNanotechnologyChemistryBiomedical Engineering
2008English

Density Functional Based Tight Binding Study of C2 and CN Deposition on (100) Diamond Surface

Materials Research Society Symposium - Proceedings
Mechanics of MaterialsMaterials ScienceCondensed Matter PhysicsMechanical Engineering
2001English

Related publications

Density Functional Theory Calculations of Adsorption-Induced Surface Stress Changes

Surface Science
SurfacesCondensed Matter PhysicsInterfacesMaterials ChemistryFilmsCoatings
2008English

Free Energy Calculations of Crystalline Hard Sphere Complexes Using Density Functional Theory

Journal of Physical Chemistry B
SurfacesTheoretical ChemistryMaterials ChemistryFilmsMedicineCoatingsPhysical
2014English

Density Functional Theory Calculations on Nitrated Boroxines as Possible High Energy-Density Materials

Ohio Journal of Sciences
Multidisciplinary
2017English

Electronic Density-Of-States of Amorphous Vanadium Pentoxide Films: Electrochemical Data and Density Functional Theory Calculations

Journal of Applied Physics
AstronomyPhysics
2014English

U and Xe Transport in UO2±x: Density Functional Theory Calculations

Physical Review B
2011English

Density-Functional-Theory Response-Property Calculations With Accurate Exchange-Correlation Potentials

Physical Review A
1998English

Synthesis and Density-Functional-Theory Calculations of Electronic Band Structure of Hollow Sphere WS2

Materials Science-Poland
Mechanics of MaterialsMaterials ScienceCondensed Matter PhysicsMechanical Engineering
2018English

Arsenic Adsorption Onto Minerals: Connecting Experimental Observations With Density Functional Theory Calculations

Minerals
Geotechnical EngineeringEngineering GeologyGeology
2014English

Finite Element Approach for Density Functional Theory Calculations on Locally-Refined Meshes

Journal of Computational Physics
Numerical AnalysisApplied MathematicsSimulationComputer Science ApplicationsModelingComputational MathematicsAstronomyPhysics
2007English

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