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Models for predicting impact sensitivity of energetic materials based on the trigger linkage hypothesis and Arrhenius kinetics
(2020)
In order to predict the impact sensitivity of high explosives, we designed and evaluated several models based on the trigger linkage hypothesis and the Arrhenius equation. To this effect, we calculated the heat of detonation, ...
Predicting scalar coupling constants via machine learning
(2021-12-22)
Over the preceding decade, machine learning techniques have been successfully applied in several
fields of research, including the prediction of chemical properties of atoms and molecules. Whereas
conventional quantum ...