CHINESE JOURNAL OF COMPUTATIONAL PHYSICS ›› 1992, Vol. 9 ›› Issue (S2): 714-716.

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COMPUTATION OF AUXILIARY FUNCTIONS IN MOLECULAR INTEGRAL UP TO ARBITRARY ACCURACY(Ⅰ)EVALUATION OF INCOMPLETE GAMMA FUNCTION BY FORWARD RECURRENCE SCHEME

Li Yanxin, Dong Xialan, Pan Shoufu   

  1. Institute of Atomic and Molecular Physics, Jilin University, Changchun 130023
  • Received:1992-01-19 Online:1992-12-31 Published:1992-12-31

Abstract: Two inequalities of incomplete Gamma function are given for the domain v∈[0,-∞) and z∈(-∞,0].Based upon the inequalities, we derive the round off error propagation regularity of the forward recurrence scheme. Our numerical experiments indicate that the relative error predicated by our regularity almost coincides with that from authentic regularity in the whole domain of v and z.

Key words: molecular integral, incomplete Gamma function, error analysis, numerical experiment, inequality