Deep learning reveals molecular secrets of explosive perchlorate salts
Perchlorates are a class of compounds that are notorious for their explosive nature. This raises safety concerns during experiments involving complex compounds that contain perchlorate ions, since explosions can be triggered even by the slightest shock or heat. It is, therefore, important to study their molecular structure and understand the reason behind their explosive nature.
In this context, a method called the Hirschfield surface analysis has been extensively used for visualizing and quantifying the crystal structure and molecular interactions of crystal compounds. Moreover, a two-dimensional fingerprint plot derived from the Hirschfield ...











