Experiences with the Cyber 205 for Quantum Chemical Calculations

This publication has 21 references indexed in Scilit:

• Implementation of an electronic structure program system on the CYBER 205
  Journal of Computational Chemistry, 1985
• Evaluation and Processing of Integrals
  Published by Springer Nature ,1984
• The direct CI method
  Molecular Physics, 1983
• Principles for a direct SCF approach to LICAO–MOab‐initio calculations
  Journal of Computational Chemistry, 1982
• Applications of the CRAY-1 for quantum chemistry calculations
  Computer Physics Communications, 1982
• Theory of magnetic susceptibilities and NMR chemical shifts in terms of localized quantities. II. Application to some simple molecules
  The Journal of Chemical Physics, 1982
• Convergence acceleration of iterative sequences. the case of scf iteration
  Chemical Physics Letters, 1980
• Evaluation of molecular integrals over Gaussian basis functions
  The Journal of Chemical Physics, 1976
• Methods for efficient evaluation of integrals for Gaussian type basis sets
  Theoretical Chemistry Accounts, 1974
• Contribution of atomic orbital integrals to symmetry orbital integrals
  The Journal of Chemical Physics, 1973