Crossref journal-article
AIP Publishing
The Journal of Chemical Physics (317)
Abstract

It is shown that the recently proposed QCI method including all single and double substitutions has essentially the same computational requirements as the more complete CCSD approach. If properly formulated, the CCSD equations contain at most quadratic terms in the excitation amplitudes.

Bibliography

Scuseria, G. E., & Schaefer, H. F. (1989). Is coupled cluster singles and doubles (CCSD) more computationally intensive than quadratic configuration interaction (QCISD)? The Journal of Chemical Physics, 90(7), 3700–3703.

Authors 2
  1. Gustavo E. Scuseria (first)
  2. Henry F. Schaefer (additional)
References 34 Referenced 1,109
  1. 10.1063/1.453520 / J. Chem. Phys. (1987)
  2. {'key': '2024021007242997000_r2'}
  3. 10.1146/annurev.pc.32.100181.002043 / Annu. Rev. Phys. Chem. (1981)
  4. 10.1103/PhysRevA.5.50 / Phys. Rev. A (1972)
  5. 10.1063/1.442131 / J. Chem. Phys. (1981)
  6. 10.1063/1.443164 / J. Chem. Phys. (1982)
  7. 10.1063/1.455269 / J. Chem. Phys. (1988)
  8. 10.1063/1.452039 / J. Chem. Phys. (1987)
  9. 10.1016/0009-2614(88)80042-3 / Chem. Phys. Lett. (1988)
  10. 10.1063/1.453655 / J. Chem. Phys. (1987)
  11. 10.1016/0009-2614(86)80461-4 / Chem. Phys. Lett. (1986)
  12. 10.1063/1.447863 / J. Chem. Phys. (1984)
  13. 10.1063/1.452293 / J. Chem. Phys. (1987)
  14. 10.1002/qua.560140503 / Int. J. Quantum Chem. (1978)
  15. {'key': '2024021007242997000_r14'}
  16. {'key': '2024021007242997000_r15'}
  17. 10.1063/1.451164 / J. Chem. Phys. (1986)
  18. {'key': '2024021007242997000_r16a', 'first-page': '437', 'volume': '20', 'year': '1986', 'journal-title': 'Int. J. Quantum Chem.'} / Int. J. Quantum Chem. (1986)
  19. 10.1016/0009-2614(87)80117-3 / Chem. Phys. Lett. (1987)
  20. 10.1021/j100322a004 / J. Phys. Chem. (1988)
  21. 10.1021/ja00219a016 / J. Am. Chem. Soc. (1988)
  22. 10.1063/1.454511 / J. Chem. Phys. (1988)
  23. 10.1021/ja00286a007 / J. Am. Chem. Soc. (1986)
  24. {'key': '2024021007242997000_r17a', 'first-page': '495', 'volume': '21', 'year': '1987', 'journal-title': 'Int. J. Quantum Chem.'} / Int. J. Quantum Chem. (1987)
  25. 10.1016/0009-2614(87)80165-3 / Chem. Phys. Lett. (1987)
  26. 10.1016/0009-2614(87)85122-9 / Chem. Phys. Lett. (1987)
  27. 10.1016/0009-2614(88)85042-5 / Chem. Phys. Lett. (1988)
  28. 10.1063/1.455477 / J. Chem. Phys. (1988)
  29. 10.1016/0009-2614(88)80360-9 / Chem. Phys. Lett. (1988)
  30. 10.1016/0009-2614(88)80300-2 / Chem. Phys. Lett. (1988)
  31. 10.1063/1.455639 / J. Chem. Phys. (1988)
  32. 10.1021/ja00230a010 / J. Am. Chem. Soc. (1988)
  33. {'key': '2024021007242997000_r17j'}
  34. {'key': '2024021007242997000_r17k'}
Dates
Type When
Created 23 years ago (July 26, 2002, 9:10 a.m.)
Deposited 1 year, 6 months ago (Feb. 10, 2024, 4:19 a.m.)
Indexed 2 weeks, 4 days ago (Aug. 6, 2025, 9:17 a.m.)
Issued 36 years, 4 months ago (April 1, 1989)
Published 36 years, 4 months ago (April 1, 1989)
Published Print 36 years, 4 months ago (April 1, 1989)
Funders 0

None

@article{Scuseria_1989, title={Is coupled cluster singles and doubles (CCSD) more computationally intensive than quadratic configuration interaction (QCISD)?}, volume={90}, ISSN={1089-7690}, url={http://dx.doi.org/10.1063/1.455827}, DOI={10.1063/1.455827}, number={7}, journal={The Journal of Chemical Physics}, publisher={AIP Publishing}, author={Scuseria, Gustavo E. and Schaefer, Henry F.}, year={1989}, month=apr, pages={3700–3703} }