Christopher J. Mundy

Pacific Northwest National Laboratory — United States

Physics and Astronomy · Physical Sciences

57h-index13.1kcitations230works4.52yr avg
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Research Topics

Spectroscopy and Quantum Chemical Studies(116), Electrostatics and Colloid Interactions(34), Advanced Chemical Physics Studies(31), Phase Equilibria and Thermodynamics(24), Quantum, superfluid, helium dynamics(24)

Publications230 total

Modeling the behavior of concentrated aqueous HNO3 using machine learning interatomic potentials
The Journal of Chemical Physics·2026Open Access
Crystalization of Nanostructured Hydroxide Films at Charged and Electrified Interfaces
ECS Meeting Abstracts·2025
Reorganization of Water at Aqueous Aluminum Chloride (AlCl <sub>3</sub> ) Interfaces: Vibrational Sum Frequency Generation and Molecular Dynamics Simulations
The Journal of Physical Chemistry A·2025
Re-Organization of Water at Aqueous Aluminum Chloride (AlCl3) Interfaces: Vibrational Sum Frequency Generation and Molecular Dynamic Simulations
2025
Incorporating the molecular-scale into a hydrodynamic description of confined aqueous systems
The Journal of Chemical Physics·2025Open Access
Re-Organization of Water at Aqueous Aluminum Chloride (AlCl3) Interfaces: Vibrational Sum Frequency Generation and Molecular Dynamic Simulations
2025
Assembled peptoid crystalline nanomaterials as carbonic anhydrase mimics for promoted hydration and sequestration of CO2
Nature Communications·2025· 9 citedOpen Access
Optimizing Data Distribution and Kernel Performance for Efficient Training of Chemistry Foundation Models: A Case Study with MACE
2025
Re-Organization of Water at Aqueous Aluminum Chloride (AlCl3) Interfaces: Vibrational Sum Frequency Generation and Molecular Dynamic Simulation
2025Open Access
STEPs-SOL, a Peptoid Force Field Parameterization to Include Solvent Effects
The Journal of Physical Chemistry B·2025· 1 cited
Optimizing Data Distribution and Kernel Performance for Efficient Training of Chemistry Foundation Models: A Case Study with MACE
arXiv (Cornell University)·2025Open Access
Impact of Colloidal Forces and Broken Symmetry on the Design of a Protein-Material Interface
2025· 1 citedOpen Access
Beyond the Debye–Hückel limit: Toward a general theory for concentrated electrolytes
The Journal of Chemical Physics·2024· 12 citedOpen Access
Colloidal phenomena reflect the interplay between interfacial solution structure, interparticle forces, and dynamical response
Current Opinion in Colloid & Interface Science·2024· 4 citedOpen Access
MixPI: Mixed-Time Slicing Path Integral Software for Quantized Molecular Dynamics Simulations
arXiv (Cornell University)·2024· 1 citedOpen Access
Formation, chemical evolution and solidification of the dense liquid phase of calcium (bi)carbonate
Nature Materials·2024· 39 citedOpen Access
Detecting underscreening and generalized Kirkwood transitions in aqueous electrolytes
The Journal of Chemical Physics·2024· 20 citedOpen Access
Smaller Is Better: The Case for Lower-Order Iodoplumbate Species Dominating MAPbI<sub>3</sub>/Dimethylformamide Solutions
Chemistry of Materials·2024· 2 citedOpen Access
Chemically Driven Multistep Crystallization in the Synthesis of Sodium Yttrium Fluoride Via a Porous, Electrochemically Active Intermediate
The Journal of Physical Chemistry C·2024· 2 citedOpen Access
Electrostatic forces drive the formation of nanostructured hydroxide films on mica
2024Open Access
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Frequent Co-authors

I‐Feng W. Kuo(20), Marcel D. Baer(17), Gregory K. Schenter(13), J. Ilja Siepmann(11), Jürg Hutter(10), Matthew J. McGrath(7), Joost VandeVondele(6), Michael L. Klein(6), Douglas J. Tobias(6), John L. Fulton(5), Matthias Krack(4), Michele Parrinello(4), Nir Goldman(4), Laurence E. Fried(4), Mark E. Tuckerman(4), James J. De Yoreo(4), Fawzi Mohamed(3), Sundaram Balasubramanian(3), Shawn M. Kathmann(3), Mirza Galib(3)