Simon R. Phillpot

United States

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Articles (20)

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2024

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2021

Collaborators (9)

Aleksandr Chernatynskiy

Assistant Professor

Missouri University of Science and Technology

UNITED STATES

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Yang Li

University of Florida

UNITED STATES

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Douglas Spearot

University of Florida

UNITED STATES

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Natalia B. Shustova

University of South Carolina

UNITED STATES

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Michael Tonks

Associate Professor

University of Florida

UNITED STATES

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Nancy Birkner

Research Assistant Professor

Clemson University

UNITED STATES

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Hans-Conrad zur Loye

University of South Carolina

UNITED STATES

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Kiyoung LEE

Assistant Professor

Hongik University

SOUTH KOREA

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Adrien Couet

UNITED STATES

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Simon R. Phillpot

Research Interests

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Articles (20)

Friends or Foes: Fundamental Principles of Th-Organic Scaffold Chemistry Using Zr-Analogs as a Guide

Solar Thermochemical Redox Cycling Using Ga- and Al-Doped LSM Perovskites for Renewable Hydrogen Production

Incorporation of Alkali Ions into Hydrated Copper Hexacyanoferrate by Density Functional Theory Calculations

Microstructure, adsorption site energetics, and formation enthalpy control for FAU-Zeolite Cs+ exchange

Effects of misfit dislocations and dislocation mobility on thermal boundary resistance of PbTe/PbSe interfaces

Binding of radionuclides and surrogate to 18-crown-6 ether by density functional theory

Phase-field model of char oxidation in ablative thermal protection system materials

Diffusion of ferrocene through vanadyl phosphate by density functional theory

Incorporating solvent effects in DFT: insights from cation exchange in faujasites

Intercalation of ferrocene into vanadyl phosphate by density functional theory

Dislocation formation in the heteroepitaxial growth of PbSe/PbTe systems

A phase-field study of stainless-steel oxidation from high-temperature carbon dioxide exposure

Migration velocities of intergranular He gas bubbles under thermal gradients in Fe by phase-field modeling

Phase-field modeling of carbon fiber oxidation coupled with heat conduction

Molecular dynamics simulation of the shock response of materials: A tutorial

Thermal conductivity of the n = 1–5 and 10 members of the (SrTiO3)nSrO Ruddlesden–Popper superlattices

High-temperature oxidation of carbon fiber and char by molecular dynamics simulation

Effect of the initial temperature on the shock response of Cu50Zr50 bulk metallic glass by molecular dynamics simulation

Generation and characterization of an improved carbon fiber model by molecular dynamics

Lattice stability and point defect energetics of TiSi2 and TiGe2 allotropes from first-principles calculations

Collaborators (9)

Aleksandr Chernatynskiy

Yang Li

Douglas Spearot

Natalia B. Shustova

Michael Tonks

Nancy Birkner

Hans-Conrad zur Loye

Kiyoung LEE

Adrien Couet

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