Chowdhury Ashraf

Extension of the ReaxFF Combustion Force Field toward Syngas Combustion and Initial Oxidation Kinetics

Chowdhury Ashraf, Adri C. T. van Duin · The Journal of Physical Chemistry A · 2017 · 370 citations

Atomistic Scale Analysis of the Carbonization Process for C/H/O/N-Based Polymers with the ReaxFF Reactive Force Field

Małgorzata Kowalik, Chowdhury Ashraf, Behzad Damirchi et al. · The Journal of Physical Chemistry B · 2019 · 271 citations · Full text

ReaxFF Simulations of Laser-Induced Graphene (LIG) Formation for Multifunctional Polymer Nanocomposites

Aniruddh Vashisth, Małgorzata Kowalik, Joseph Gerringer et al. · ACS Applied Nano Materials · 2020 · 179 citations · Full text

Engineering, Polymer Nanocomposites, Chemistry +17

Accelerated ReaxFF Simulations for Describing the Reactive Cross-Linking of Polymers

Aniruddh Vashisth, Chowdhury Ashraf, Weiwei Zhang et al. · The Journal of Physical Chemistry A · 2018 · 172 citations

Engineering, Mechanical Engineering, Computational Chemistry +17

Pyrolysis of binary fuel mixtures at supercritical conditions: A ReaxFF molecular dynamics study

Chowdhury Ashraf, Sharmin Shabnam, Abhishek Jain et al. · Fuel · 2018 · 126 citations

Chemical Engineering, Engineering, Binary Fuel Mixtures +10