David Furman
David Furman
Herchel Smith Research Fellow and Darwin Research Fellow, University of Cambridge
Verified email at cam.ac.uk
Title
Cited by
Cited by
Year
Decomposition of condensed phase energetic materials: Interplay between uni- and bimolecular mechanisms
D Furman, R Kosloff, F Dubnikova, SV Zybin, WA Goddard III, N Rom, ...
Journal of the American Chemical Society 136 (11), 4192-4200, 2014
1222014
First-principles-based reaction kinetics for decomposition of hot, dense liquid TNT from ReaxFF multiscale reactive dynamics simulations
N Rom, B Hirshberg, Y Zeiri, D Furman, SV Zybin, WA Goddard III, ...
The Journal of Physical Chemistry C 117 (41), 21043-21054, 2013
642013
Enhanced Particle Swarm Optimization Algorithm: Efficient Training of ReaxFF Reactive Force Fields
D Furman, B Carmeli, Y Zeiri, R Kosloff
Journal of Chemical Theory and Computation 14 (6), 3100-3112, 2018
272018
Reactive force field for liquid hydrazoic acid with applications to detonation chemistry
D Furman, F Dubnikova, ACT Van Duin, Y Zeiri, R Kosloff
The Journal of Physical Chemistry C 120 (9), 4744-4752, 2016
232016
Thermal Decomposition of Erythritol Tetranitrate: A Joint Experimental and Computational Study
JC Oxley, D Furman, AC Brown, F Dubnikova, JL Smith, R Kosloff, Y Zeiri
The Journal of Physical Chemistry C 121 (30), 16145–16157, 2017
222017
Effects of nanoscale heterogeneities on the reactivity of shocked erythritol tetranitrate
D Furman, R Kosloff, Y Zeiri
The Journal of Physical Chemistry C 120 (50), 28886-28893, 2016
222016
Transforming the Accuracy and Numerical Stability of ReaxFF Reactive Force Fields
D Furman, DJ Wales
The Journal of Physical Chemistry Letters 10 (22), 7215-7223, 2019
162019
Cavitation-Induced Synthesis of Biogenic Molecules on Primordial Earth
NH Kalson, D Furman, Y Zeiri
ACS Central Science 3 (9), 1041-1049, 2017
142017
Mechanism of intact adsorbed molecules ejection using high intensity laser pulses
D Furman, R Kosloff, Y Zeiri
The Journal of Physical Chemistry C 120 (20), 11306-11312, 2016
142016
Modeling Diffusion in Functional Materials: From Density Functional Theory to Artificial Intelligence
Y Elbaz, D Furman, M Caspary Toroker
Advanced Functional Materials 1900778, 2019
132019
A Well-behaved Theoretical Framework for ReaxFF Reactive Force Fields
D Furman, DJ Wales
The Journal of Chemical Physics 153 (2), 2020
52020
Hydrogen Transfer through Different Crystal Phases of Nickel Oxy/hydroxide
Y Elbaz, D Furman, M ,Caspary-Toroker
Physical Chemistry Chemical Physics, 25169-25178, 2018
42018
Electronic structure of β-NiOOH with hydrogen vacancies and implications for energy conversion applications
V Fidelsky, D Furman, Y Khodokovsky, Y Elbaz, Y Zeiri, ...
MRS Communications, 1-8, 2017
32017
Development of ReaxFF Reactive Force Field for Aqueous Iron–Sulfur Clusters with Applications to Stability and Reactivity in Water
E Moerman, D Furman, DJ Wales
Journal of Chemical Information and Modeling 61 (3), 2021
12021
Systematic Evaluation of ReaxFF Reactive Force Fields for Biochemical Applications
E Moerman, D Furman, DJ Wales
Journal of Chemical Theory and Computation 17 (1), 2020
2020
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Articles 1–15