Artificial neural networks(ANNs)have been widely used to fit the potential energy surface.Levenberg-Maquard(LM)algorithm is a powerful neural network traini
Alkenes are not only important components of realistic fuels,but also important intermediates during combustion processes for all hydrocarbon and many alter
Quantum chemistry calculations and thermodynamics methods were carried out to screen out novel high energy density materials(HEDMs)from several new derivati
The cooperation and competition of halogen bonding and hydrogen bonding have arisen recent interest in the formation of 2D self-assembled molecular arrays o