Australian National UniversityQuantum Chemistry at ANU
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Papers of 1996

  1. 58. Advances in methodologies for linear-scaling density functional calculations BG Johnson, CA White, Q Zhang, B Chen, RL Graham, PMW Gill, M Head-Gordon, in Recent developments and applications of modern density functional theory (Elsevier, Amsterdam, 1996)
  2. 57. A family of attenuated Coulomb operators PMW Gill, RD Adamson Chem Phys Lett 261 (1996) 105
  3. 56. A new gradient-corrected exchange functional PMW Gill Mol Phys 89 (1996) 433
  4. 55. Extraction of Stewart atoms from electron densities PMW Gill J Phys Chem 100 (1996) 15421
  5. 54. Coulomb-attenuated exchange energy density functionals PMW Gill, RD Adamson, JA Pople Mol Phys 88 (1996) 1005
  6. 53. Chemistry without Coulomb tails RD Adamson, JP Dombroski, PMW Gill Chem Phys Lett 254 (1996) 329
  7. 52. Linear scaling DFT calculations via the Continuous Fast Multipole Method CA White, BG Johnson, PMW Gill, M Head-Gordon Chem Phys Lett 253 (1996) 268
  8. 51. Density functional partitions JA Pople, RD Adamson, PMW Gill J Phys Chem 100 (1996) 6348
  9. 50. KWIK: Coulomb energies in O(N) work JP Dombroski, RD Adamson, PMW Gill J Phys Chem 100 (1996) 6272
  10. 49. Comment on "A generalized fast multipole approach for HF and DFT calculations" CA White, BG Johnson, PMW Gill, M Head-Gordon Chem Phys Lett 248 (1996) 482