Chem. J. Chinese Universities ›› 1984, Vol. 5 ›› Issue (4): 571.

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Quantum Chemical Calculation of the Force Constants of Mg2+ and Other Diatomic Systems

Dai Dingguo, Chen Nianyi   

  1. Department of Chemistry, Tongji University, Shanghai
  • Received:1982-11-25 Online:1984-10-24 Published:1984-10-24

Abstract: The force constants of HF, Mg2+, Mg22+ and [HeNe]2+ were calculated by ab initio method of quantum chemical calculation. Some ther-modynamic quantities of these chemical species, including the S700K0 and △Hf0 of Mg22+ ion, were estimated.

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