Feng Wang

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Associate Professor

University of Arkansas at Fayetteville

United States

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Feng Wang is an Associate Professor at the University of Arkansas Fayetteville, USA. His research primarily focuses on adaptive force matching potentials, molecular dynamics simulations, and the synthesis of nanoparticles. Recent articles authored by him delve into the structural evolution of nanocatalysts and advancements in computational chemistry methodologies. Through his work, he aims to enhance the understanding of molecular interactions and materials science.

Recent Grants

Grant: Close

SusChEM: Multiscale Interaction Potentials for Cellulose

Open Date: 2016-07-01

Close Date: 2019-06-01

Articles (15)

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2025

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2020

Collaborators (3)

Yong Wang

University of Arkansas

UNITED STATES

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Jingyi Chen

Professor

University of Arkansas at Fayetteville

UNITED STATES

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Ulrich H.E. Hansmann

Professor

University of Oklahoma

UNITED STATES

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Feng Wang

Research Interests

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About

Recent Grants

Articles (15)

An Adaptive Force Matching Potential for Alanine Developed with Møller–Plesset Perturbation Theory and Smooth Fourier Transform Correction Map

Revealing Structural Evolution of Nickel Phosphide-Iron Oxide Core–Shell Nanocatalysts in Alkaline Medium for the Oxygen Evolution Reaction

Simulation of Linear and Cyclic Alkanes with Second-Order Møller–Plesset Perturbation Theory through Adaptive Force Matching

Water Potential from Adaptive Force Matching for Ice and Liquid with Revised Dispersion Predicts Supercooled Liquid Anomalies in Good Agreement with Two Independent Experimental Fits

Synthesis of Amorphous and Various Phase-Pure Nanoparticles of Nickel Phosphide with Uniform Sizes via a Trioctylphosphine-Mediated Pathway

Dipole Cooperativity and Polarization Frustration Determine the Secondary Structure Distribution of Short Alanine Peptides in Water

Simulating a flexible water model as rigid: Best practices and lessons learned

Fragmentation Method for Computing Quantum Mechanics and Molecular Mechanics Gradients for Force Matching: Validation with Hydration Free Energy Predictions Using Adaptive Force Matching

Performing Molecular Dynamics Simulations and Computing Hydration Free Energies on the B3LYP-D3(BJ) Potential Energy Surface with Adaptive Force Matching: A Benchmark Study with Seven Alcohols and One Amine

A comparison of three DFT exchange–correlation functionals and two basis sets for the prediction of the conformation distribution of hydrated polyglycine

Real-Time Imaging of Laser-Induced Nanowelding of Silver Nanoparticles in Solution

Determining the hydration free energies of selected small molecules with MP2 and local MP2 through adaptive force matching

Development and Validation of a DFT-Based Force Field for a Hydrated Homoalanine Polypeptide

Accurate MP2-based force fields predict hydration free energies for simple alkanes and alcohols in good agreement with experiments

Altering the Solubility of the Antibiotic Candidate Nisin—A Computational Study

Collaborators (3)

Yong Wang

Jingyi Chen

Ulrich H.E. Hansmann

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