Aditya Lele

TL;DR: In this paper, the initial stages of the pyrolysis of HtH-1 (C18H32; 2,2,7,7-8a,8b-hexamethyl-dodecahydrobiphenylene) and Ht H-2 (C 18H34; 1,1′,3,3-3-4,3′, 3′)-polycyclic alkanes and potential jet fuels, using ReaxFF force field based molecular dynamics simulations, were investigated.

TL;DR: In this article, the initial fuel pyrolysis of four bicyclic compounds, which are potential alternative jet fuels, using ReaxFF force field based molecular dynamics simulations was investigated.

TL;DR: In this article, the influence of the LNG composition on the ignition delay time and thus the knocking behavior of prototypical LNG Mixtures was investigated in the presence of a shock tube and a rapid compression machine facility.

TL;DR: Narayanaswamy et al. as mentioned in this paper derived a compact reaction scheme for methyl butanoate, which is a potentially important candidate for biodiesel surrogates, from a detailed reference mechanism.

TL;DR: In this paper, the authors investigated the possible bending of graphene in vacuum and near copper surfaces and described the energy cost for graphene bending and the binding energy with hydrogen and copper with two different ReaxFF parameter sets, demonstrating the relevance of using the more recently developed Reax FF parameter sets for graphene properties.