118
S.O. Adamson et al.
37. Burke PG, Seaton MJ (1971) In: Alder B, Frenbach S, Rotenberg M (eds) Methods in computational physics. Atomic and molecular scattering, vol 10. Academic Press, New York.
Chap. 1, and references therein
38. Harris FE, Michels HH (1971) In: Alder B, Frenbach S, Rotenberg M (eds) Methods in computational physics. Atomic and molecular scattering, vol 10. Academic Press, New York.
Chap. 4, and references therein
39. Matese JJ, Oberoi RS (1971) Choosing pseudostates in the close-coupling formalism for
electron-atomic-hydrogen system. Phys Rev A 4:569–579
40. Abramowitz M, Stegun I (eds) (1964) Handbook of mathematical functions with formulas,
graphs, and mathematical tables. NBS app math series, vol 55. Government Printing Office,
Washington
41. Bateman H, Erdlyi A (1953) Higher transcendental functions, vols 1, 2. McGraw-Hill, NewYork
42. O-ohata K, Taketa H, Huzinaga S (1966) Gaussian expansions of atomic orbitals. J Phys Soc
Jpn 21:2306–2313
43. Hehre WJ, Ditchfield R, Stewart RF, Pople JA (1970) Self-consistent molecular orbital
methods. IV. Use of Gaussian expansions of Slater-type orbitals. Extension to second-row
molecules. J Chem Phys 52:2769–2773
44. Widmark P-O, Persson BJ, Roos BO (1991) Density matrix averaged atomic natural orbital
(ANO) basis sets for correlated molecular wave functions. Theor Chim Acta 79:419–432
45. Sadlej AJ (1992) Medium-size polarized basis sets for high-level-correlated calculations of
molecular electric properties. Theor Chim Acta 81:339–354
46. Wallis A, McElwain DLS, Pritchard HO (1969) The variation method and the algebraic eigenvalue problem. Int J Quant Chem 3:711–722
47. Moncrieff D, Wilson S (2005) Computational linear dependence in molecular electronic structure calculations using universal basis sets. Int J Quant Chem 101:363–371, and references
therein
48. Yoshida T (1995) Computation of Kummer functions U(a, b, x) for large argument x by using
the τ -method. Inf Process Soc Jpn 36:2335–2342
49. Temme NM (1983) The numerical computation of the confluent hypergeometric function
U(a, b, z). Numer Math 41:63–82
50. Maier CH, Cederbaum LS (1980) A spherical-box approach to resonances. J Phys B, Atom
Mol Phys 13:L119–L124
51. Gersbacher R, Broad JT (1990) Resonances in helium photoionisation. J Phys B 23:365–384
52. Guseinov II, Mamedov BA (2004) Evaluation of incomplete Gamma functions using downward recursion and analytical relations. J Math Chem 36:341–346
53. Eyring H, Walter J, Kimball GE (1944) Quantum chemistry. Wiley, New York
54. Holøien E, Midtdal J (1955) On a metastable energy state of the negative helium ion. Proc
Phys Soc A 68:815–823
55. Condon EU, Shortley GH (1959) The theory of atomic spectra, 6th edn. Cambridge University
Press, Cambridge
56. Schwartz C (1962) Importance of angular correlations between atomic electrons. Phys Rev
126:1015–1019
57. Goldman SP (1997) Accurate modified configuration interaction calculations for many electron systems made easy. Phys Rev Lett 78:2325–2328, and references therein
S.O. Adamson et al.
37. Burke PG, Seaton MJ (1971) In: Alder B, Frenbach S, Rotenberg M (eds) Methods in computational physics. Atomic and molecular scattering, vol 10. Academic Press, New York.
Chap. 1, and references therein
38. Harris FE, Michels HH (1971) In: Alder B, Frenbach S, Rotenberg M (eds) Methods in computational physics. Atomic and molecular scattering, vol 10. Academic Press, New York.
Chap. 4, and references therein
39. Matese JJ, Oberoi RS (1971) Choosing pseudostates in the close-coupling formalism for
electron-atomic-hydrogen system. Phys Rev A 4:569–579
40. Abramowitz M, Stegun I (eds) (1964) Handbook of mathematical functions with formulas,
graphs, and mathematical tables. NBS app math series, vol 55. Government Printing Office,
Washington
41. Bateman H, Erdlyi A (1953) Higher transcendental functions, vols 1, 2. McGraw-Hill, NewYork
42. O-ohata K, Taketa H, Huzinaga S (1966) Gaussian expansions of atomic orbitals. J Phys Soc
Jpn 21:2306–2313
43. Hehre WJ, Ditchfield R, Stewart RF, Pople JA (1970) Self-consistent molecular orbital
methods. IV. Use of Gaussian expansions of Slater-type orbitals. Extension to second-row
molecules. J Chem Phys 52:2769–2773
44. Widmark P-O, Persson BJ, Roos BO (1991) Density matrix averaged atomic natural orbital
(ANO) basis sets for correlated molecular wave functions. Theor Chim Acta 79:419–432
45. Sadlej AJ (1992) Medium-size polarized basis sets for high-level-correlated calculations of
molecular electric properties. Theor Chim Acta 81:339–354
46. Wallis A, McElwain DLS, Pritchard HO (1969) The variation method and the algebraic eigenvalue problem. Int J Quant Chem 3:711–722
47. Moncrieff D, Wilson S (2005) Computational linear dependence in molecular electronic structure calculations using universal basis sets. Int J Quant Chem 101:363–371, and references
therein
48. Yoshida T (1995) Computation of Kummer functions U(a, b, x) for large argument x by using
the τ -method. Inf Process Soc Jpn 36:2335–2342
49. Temme NM (1983) The numerical computation of the confluent hypergeometric function
U(a, b, z). Numer Math 41:63–82
50. Maier CH, Cederbaum LS (1980) A spherical-box approach to resonances. J Phys B, Atom
Mol Phys 13:L119–L124
51. Gersbacher R, Broad JT (1990) Resonances in helium photoionisation. J Phys B 23:365–384
52. Guseinov II, Mamedov BA (2004) Evaluation of incomplete Gamma functions using downward recursion and analytical relations. J Math Chem 36:341–346
53. Eyring H, Walter J, Kimball GE (1944) Quantum chemistry. Wiley, New York
54. Holøien E, Midtdal J (1955) On a metastable energy state of the negative helium ion. Proc
Phys Soc A 68:815–823
55. Condon EU, Shortley GH (1959) The theory of atomic spectra, 6th edn. Cambridge University
Press, Cambridge
56. Schwartz C (1962) Importance of angular correlations between atomic electrons. Phys Rev
126:1015–1019
57. Goldman SP (1997) Accurate modified configuration interaction calculations for many electron systems made easy. Phys Rev Lett 78:2325–2328, and references therein