A B3LYP and MP2(full) theoretical investigation into explosive sensitivity upon the formation of the molecule-cation interaction between the nitro group of 3,4-dinitropyrazole and H+, Li+, Na+, Be2+or Mg2+

✍ Scribed by Shan Du; Yong Wang; Li-zhen Chen; Wen-jing Shi; Fu-de Ren; Yong-xiang Li; Jian-long Wang; Duan-lin Cao

• Book ID: 113053325
• Publisher: Springer-Verlag
• Year: 2011
• Tongue: English
• Weight: 412 KB
• Volume: 18
• Category: Article
• ISSN: 1610-2940
• DOI: 10.1007/s00894-011-1229-7