First-principles investigations of proton generation in <italic>α</italic>-quartz

First-principles investigations of proton generation in α-quartz

Yue Yunliang¹, Song Yu^{2, 3}, Zuo Xu^{1, 4, †}

(color online) The reaction curve of the proton liberated from the positively charged H B + configuration. The structures of the initial, transition, and final states are illustrated in the insets.