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Convergence acceleration of iterative sequences. the case of scf iteration
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Citations
Cited by
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
Kresse, G., & Furthmüller, J. (1996) · Physical Review B · doi:10.1103/physrevb.54.11169 · Cited by 123,652
te Velde, G., Bickelhaupt, F. M., Baerends, E. J., Fonseca Guerra, C., van Gisbergen, S. J. A., Snijders, J. G., & Ziegler, T. (2001) · Journal of Computational Chemistry · doi:10.1002/jcc.1056 · Cited by 10,152
Kühne, T. D., Iannuzzi, M., Del Ben, M., Rybkin, V. V., Seewald, P., Stein, F., Laino, T., Khaliullin, R. Z., Schütt, O., Schiffmann, F., et al. (2020) · The Journal of Chemical Physics · doi:10.1063/5.0007045 · Cited by 4,468
OpenMM 7: Rapid development of high performance algorithms for molecular dynamics
Eastman, P., Swails, J., Chodera, J. D., McGibbon, R. T., Zhao, Y., Beauchamp, K. A., Wang, L.-P., Simmonett, A. C., Harrigan, M. P., Stern, C. D., et al. (2017) · PLOS Computational Biology · doi:10.1371/journal.pcbi.1005659 · Cited by 2,748
Noisy intermediate-scale quantum algorithms
Bharti, K., Cervera-Lierta, A., Kyaw, T. H., Haug, T., Alperin-Lea, S., Anand, A., Degroote, M., Heimonen, H., Kottmann, J. S., Menke, T., et al. (2022) · Reviews of Modern Physics · doi:10.1103/revmodphys.94.015004 · Cited by 2,231
Metadata
- Authors
- Pulay, P.
- Venue
- Chemical Physics Letters
- Publisher
- Elsevier BV
- Published
- 1980-07
- Volume
- 73
- Issue
- 2
- Pages
- 393-398
- ISSN
- 0009-2614 (ISSN-L)
- OpenAlex
- W2013183108
- Cited by
- 2,612
- References
- 0
- FWCI
- 3.98
- Type
- journal article
- Language
- en
- Open access
- closed
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- CoChat. (2026). Citation check: Convergence acceleration of iterative sequences. the case of scf iteration. https://app.cochat.ai/papers/10.1016/0009-2614(80)80396-4
- The paper
- Pulay, P. (1980). Convergence acceleration of iterative sequences. the case of scf iteration. Chemical Physics Letters. https://doi.org/10.1016/0009-2614(80)80396-4
Data sources
Bibliographic data: Semantic Scholar, OpenAlex, Crossref.
Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).
Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.
