I‐Feng W. Kuo

Lawrence Livermore National Laboratory — United States

Physics and Astronomy · Physical Sciences

35h-index4.7kcitations101works3.92yr avg
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Research Topics

Spectroscopy and Quantum Chemical Studies(38), Energetic Materials and Combustion(17), Phase Equilibria and Thermodynamics(15), Advanced Chemical Physics Studies(14), Quantum, superfluid, helium dynamics(10)

Publications101 total

Hierarchical transfer learning: an agile and equitable strategy for machine-learning interatomic models
npj Computational Materials·2026· 1 citedOpen Access
Water‐mediated Decomposition Pathways of ε‐Hexanitrohexaazaisowurtzitane
Propellants Explosives Pyrotechnics·2025· 1 cited
Hierarchical Transfer Learning: An Agile and Equitable Strategy for Machine-Learning Interatomic Models
2025· 1 citedOpen Access
Herbal nanoemulsions in cosmetic science: A comprehensive review of design, preparation, formulation, and characterization
Journal of Food and Drug Analysis·2024· 21 citedOpen Access
Uncertainty quantification of material parameters in modeling coupled metal and high explosive experiments
Journal of Applied Physics·2024· 3 citedOpen Access
HE Validation Suite (HEVS): An automated approach to verify and validate HE models.
OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)·2024Open Access
Hierarchical Transfer Learning: An Agile and Equitable Strategy for Machine-Learning Interatomic Models
2024Open Access
Ab initio structural dynamics of pure and nitrogen-containing amorphous carbon
Scientific Reports·2023· 12 citedOpen Access
CCDC 2265262: Experimental Crystal Structure Determination
The Cambridge Structural Database·2023Open Access
Vibrational Spectra of HNIW and its Isotopologues: A Combined Experimental and Computational Study
Propellants Explosives Pyrotechnics·2023· 2 citedOpen Access
Single-Step Mechanism for Regioselective Nitration of 9,10-BN-Naphthalene with Acetyl Nitrate in the Gas Phase
The Journal of Physical Chemistry A·2022· 6 citedOpen Access
High-Pressure Investigation of 2,4,6-Trinitro-3-bromoanisole (TNBA): Structural Determination and Piezochromism
The Journal of Physical Chemistry C·2022· 11 citedOpen Access
Mono- and Dinitro-BN-Naphthalenes: Formation and Characterization
Molecules·2021· 4 citedOpen Access
Enhancements supporting IC usage of PEM libraries on next-gen platforms
2021· 1 citedOpen Access
The High-Pressure Equation of State of TATB: Insights on the Monoclinic Phase Transition, Hydrogen Bonding, and Anharmonicity
Bulletin of the American Physical Society·2021
Predicted Reaction Mechanisms, Product Speciation, Kinetics, and Detonation Properties of the Insensitive Explosive 2,6-Diamino-3,5-dinitropyrazine-1-oxide (LLM-105)
The Journal of Physical Chemistry A·2021· 38 citedOpen Access
High-Pressure Equation of State of 1,3,5-triamino-2,4,6-trinitrobenzene: Insights into the Monoclinic Phase Transition, Hydrogen Bonding, and Anharmonicity
The Journal of Physical Chemistry A·2020· 24 citedOpen Access
Atomistic Predictions for Reaction Mechanisms, Kinetics, and Detonation Properties of the Insensitive Explosive LLM-105
Bulletin of the American Physical Society·2020
Mechanochemical synthesis of glycine oligomers in a virtual rotational diamond anvil cell
Chemical Science·2020· 39 citedOpen Access
An Isosymmetric High-Pressure Phase Transition in α-Glycylglycine: A Combined Experimental and Theoretical Study
The Journal of Physical Chemistry B·2019· 17 citedOpen Access
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Frequent Co-authors

Christopher J. Mundy(30), J. Ilja Siepmann(17), Matthew J. McGrath(16), Douglas J. Tobias(8), Jürg Hutter(7), Laurence E. Fried(7), Joost VandeVondele(6), Nir Goldman(5), Brad A. Steele(5), Matthew P. Kroonblawd(5), Fawzi Mohamed(4), Matthias Krack(4), Marcel D. Baer(4), Elissaios Stavrou(4), Joseph M. Zaug(3), Shawn M. Kathmann(3), Julius Numbonui Ghogomu(3), M. Riad Manaa(3), Michiel Sprik(2), Michael L. Klein(2)