The evolution of geometric structures, electronic properties, and chemical bonding of small phosphorus-boron clusters

HIGHLIGHTS

  • who: Limei Wen and collaborators from the Hubei Key Laboratory of Bioinorganic and Materia Medica, School of and, Huazhong University of Science and Technology, Wuhan, China have published the article: The Evolution of Geometric Structures, Electronic Properties, and Chemical Bonding of Small Phosphorus-Boron Clusters, in the Journal: (JOURNAL) of 20/02/2022
  • what: The authors report a comprehensive theoretical investigation on phosphorus-boron mixed neutral anionic and cationic clusters P2 Bn /P2 Bn - /P2 Bn + (n = 3-7) with two phosphorus atoms and three to seven boron atoms. This is the main reason the . . .

     

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