Electronic and magnetic structures of new interstitial boron sub-oxides b12o2:x (x = b, c, n, o)

HIGHLIGHTS

  • who: Samir F. Matar and Jean Etourneau from the Lebanese German University, Sahel-Alma, Jounieh, Lebanon have published the article: Electronic and Magnetic Structures of New Interstitial Boron Sub-Oxides B12O2:X (X = B, C, N, O), in the Journal: Molecules 2021, 123 of /2021/
  • what: While other PDOS features are similar to the above discussion, the authors focus on the DOS at EF: n(EF ) in such spin degenerate NSP calculations.
  • how: The structural results are shown in Table 1 and they will be discussed in the next section focusing here on . . .

     

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