Acta Chimica Sinica ›› 1984, Vol. 42 ›› Issue (9): 843-849.     Next Articles

Original Articles

Hellmam-Feynman力的ad initio计算及在化学键研究中的应用I.理论与计算

杜奇石;彭周人   

  1. 兰州大学化学系
  • 发布日期:1984-09-15

The ad initio calculation of the hellmann-feynman force and its applications in the study on the chemical bond. I. The theory and the calculation

DU QISHI;PENG ZHOUREN   

  • Published:1984-09-15

Key words: APPLICATION, CALCULATION, CHEMICAL BONDS, WAVE FUNCTIONS, AB INITIO CALCULATION, QUANTUM MECHANICS, ELECTROSTATIC FORCE

CLC Number: