標題: | Toward Exact Analytical Wave Function of Helium Atom: Two Techniques for Constructing Homogeneous Functions of Kinetic Energy Operator |
作者: | He Bing-Hau Witek, Henryk A. 應用化學系 應用化學系分子科學碩博班 Department of Applied Chemistry Institute of Molecular science |
關鍵字: | Helium atom;Homogeneous solutions of PDE;Exact wave function |
公開日期: | 1-一月-2016 |
摘要: | We discuss two general techniques for constructing homogeneous functions c of the kinetic energy operator T for the helium atom in a state of symmetry S. The first technique is based on algebraic identification of the kernel of T in a space spanned by some predetermined set of basis functions. The second technique, analytic in nature, constructs the homogeneous functions of T as formal power series with coefficients deduced from recurrence relations stemming from the requirement Tc=0. Both approaches are capable of producing a great variety of homogeneous functions c with arbitrary homogeneity that can prove useful for constructing the exact ground state wave function for the helium atom. |
URI: | http://dx.doi.org/10.1002/jccs.201500086 http://hdl.handle.net/11536/129696 |
ISSN: | 0009-4536 |
DOI: | 10.1002/jccs.201500086 |
期刊: | JOURNAL OF THE CHINESE CHEMICAL SOCIETY |
Volume: | 63 |
起始頁: | 69 |
結束頁: | 82 |
顯示於類別: | 期刊論文 |