CIV3 — A general program to calculate configuration interaction wave functions and electric-dipole oscillator strengths

An efficient method for finding the minimum of a function of several variables without calculating derivatives

M. J. D. Powell · The Computer Journal · 1964 · 4.6K citations

Computing, Computer Science, Algorithms +9

A Rapidly Convergent Descent Method for Minimization

R. Fletcher, M. J. D. Powell · The Computer Journal · 1963 · 4.6K citations · Full text

Computing, Computer Science, Mathematics +11

Ab Initio Computations in Atoms and Molecules

E. Clementi · IBM Journal of Research and Development · 1965 · 1.5K citations

Natural Sciences, Chemistry, Physics +17

A multi-configuration Hartree-Fock program with improved stability

Charlotte Froese Fischer · Computer Physics Communications · 1972 · 547 citations

Natural Sciences, Computer Science, Computational Chemistry +6

A multi-configuration Hartree-Fock program

Charlotte Froese Fischer · Computer Physics Communications · 1970 · 372 citations

Computing, Computer Science, Parallel Computing +4