Accurate ab initio theoretical studies of rovibronic states of some simple diatomic molecules

[目次]

  • Contents / p1
  • 1 General Introduction / p1
  • 2 Accurate potential energy and transition dipole moment curves of the X²Σ⁺,A²Π and B²Σ⁺ states of CO⁺ / p5
  • 2.I INTRODUCTION / p6
  • 2.II CALCULATION / p7
  • 2.III RESULTS AND DISCUSSION / p10
  • 2.IV CONCLUDING REMARKS / p15
  • 2.V ACKNOWLEGMENT / p15
  • 3 Accurate ab initio MO studies of three ²Π states of CO₊ / p29
  • 3.1 Introduction / p30
  • 3.2 Theoretical Methods / p31
  • 3.3 Results and Discussion / p32
  • 3.4 Conclusion / p38
  • 3.5 Acknowledgment / p38
  • 4 Theoretical studies of Einstein's A and B coefficients of rovibrational transitions for carbon monoxide: simulation of temperature distribution of CO in the solar atmosphere / p49
  • 4.1 Introduction / p50
  • 4.2 Calculation / p51
  • 4.3 Results and discussion / p52
  • 4.4 Concluding remarks / p58
  • 5 Accurate potential energy and transition dipole moment curves for several electronic states of [数式] / p77
  • 5.1 Introduction / p78
  • 5.2 Calculation / p79
  • 5.3 Results and discussion / p80
  • 5.4 Conclusion / p84
  • 6 General Conclusion / p99
  • Acknowledgment / p101

「国立国会図書館デジタルコレクション」より

この本の情報

書名 Accurate ab initio theoretical studies of rovibronic states of some simple diatomic molecules
著作者等 Kazutoshi Okada
岡田 一俊
刊行年月 1999
言語 英語
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