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Volumn 71, Issue 10, 1979, Pages 4142-4163

Piecewise polynomial configuration interaction natural orbital study of 1 s2 helium

Author keywords

CONFIGURATION INTERACTION; ELECTRONIC STRUCTURE; HELIUM; MOLECULAR ORBITAL METHOD; S STATES; WAVE FUNCTIONS

Indexed keywords


EID: 84951353411     PISSN: 00219606     EISSN: 10897690     Source Type: Journal    
DOI: 10.1063/1.438187     Document Type: Article
Times cited : (227)

References (56)
  • 20
    • 0004189166 scopus 로고
    • See, for instance (Prentice-Hall, Engelwood Cliffs)
    • See, for instance, Martin H. Schultz, Spline Analysis (Prentice-Hall, Engelwood Cliffs) 1973.
    • (1973) Spline Analysis
    • Schultz, M.H.1
  • 34
    • 84953672036 scopus 로고
    • Doctoral thesis, Johns Hopkins University, available through University Microfilms (Ann Arbor, MI), Dissertation No. DAH 76-22937;
    • G. O. Morrell, Jr., Doctoral thesis, Johns Hopkins University, 1976, available through University Microfilms (Ann Arbor, MI), Dissertation No. DAH 76-22937;
    • (1976)
    • Morrell, G.O.1
  • 36
    • 34548398122 scopus 로고
    • the preceding paper.
    • G. O. Morrell, Jr., and R. G. Parr, J. Chem. Phys. 71, 4139 (1979), the preceding paper.
    • (1979) J. Chem. Phys , vol.71 , pp. 4139
    • Morrell, G.O.1    Parr, R.G.2
  • 37
    • 84953672038 scopus 로고    scopus 로고
    • The constants actually used to calculate the [formula omitted] in Table IX were 0.07400947 a.u. and 0.03136703 a.u., but we regard 0.0740 and 0.031 to be more indicative of the precision to which A and B have been obtained.
    • The constants actually used to calculate the [formula omitted] in Table IX were 0.07400947 a.u. and 0.03136703 a.u., but we regard 0.0740 and 0.031 to be more indicative of the precision to which A and B have been obtained.
  • 52
    • 84953672040 scopus 로고
    • EIGEN, Program 172.1, Quantum Chemistry Program Exchange (Indiana University, Bloomington, Indiana)
    • I. Shavitt, EIGEN, Program 172.1, Quantum Chemistry Program Exchange (Indiana University, Bloomington, Indiana) 1970.
    • (1970)
    • Shavitt, I.1
  • 56
    • 0002164576 scopus 로고
    • Many body perturbation calculations and coupled electron pair models
    • R. Ahlrichs, “Many body perturbation calculations and coupled electron pair models,” Computer Physics Commun. 17, 31 (1979).
    • (1979) Computer Physics Commun , vol.17 , pp. 31
    • Ahlrichs, R.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.