First-principles band gap criterion for impact sensitivity of energetic crystals: a review

Structural Chemistry - Tập 21 Số 3 - Trang 657-665 - 2010
Weihua Zhu1, Heming Xiao1
1Institute for Computation in Molecular and Materials Science and Department of Chemistry, Nanjing University of Science and Technology, Nanjing 210094, China

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