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Alistair Rendell

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Professor Alistair Rendell

 https://orcid.org/0000-0002-9445-0146
1985 …2023

Research activity per year

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Expertise related to UN Sustainable Development Goals

In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):

  1. SDG 7 - Affordable and Clean Energy
    SDG 7 Affordable and Clean Energy
  2. SDG 12 - Responsible Consumption and Production
    SDG 12 Responsible Consumption and Production

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Collaborations and top research areas from the last five years

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  • Scaling Correlated Fragment Molecular Orbital Calculations on Summit

    Barca, G. M. J., Snowdon, C., Vallejo, J. L. G., Kazemian, F., Rendell, A. P. & Gordon, M. S., 23 Feb 2023, Proceedings of SC 2022: International Conference for High Performance Computing, Networking, Storage and Analysis. Institute of Electrical and Electronics Engineers, 14 p. (International Conference for High Performance Computing, Networking, Storage and Analysis, SC; vol. 2022-November).

    Research output: Chapter in Book/Report/Conference proceeding › Conference contribution › peer-review

    19 Citations (Scopus)

  • The General Atomic and Molecular Electronic Structure System (GAMESS): Novel Methods on Novel Architectures

    Zahariev, F., Xu, P., Westheimer, B. M., Webb, S., Galvez Vallejo, J., Tiwari, A., Sundriyal, V., Sosonkina, M., Shen, J., Schoendorff, G., Schlinsog, M., Sattasathuchana, T., Ruedenberg, K., Roskop, L. B., Rendell, A. P., Poole, D., Piecuch, P., Pham, B. Q., Mironov, V. & Mato, J. & 18 others, Leonard, S., Leang, S. S., Ivanic, J., Hayes, J., Harville, T., Gururangan, K., Guidez, E., Gerasimov, I. S., Friedl, C., Ferreras, K. N., Elliott, G., Datta, D., Cruz, D. D. A., Carrington, L., Bertoni, C., Barca, G. M. J., Alkan, M. & Gordon, M. S., 24 Oct 2023, In: Journal of Chemical Theory and Computation. 19, 20, p. 7031-7055 25 p.

    Research output: Contribution to journal › Article › peer-review

    71 Citations (Scopus)

  • Toward an extreme-scale electronic structure system

    Galvez Vallejo, J. L., Snowdon, C., Stocks, R., Kazemian, F., Yan Yu, F. C., Seidl, C., Seeger, Z., Alkan, M., Poole, D., Westheimer, B. M., Basha, M., De La Pierre, M., Rendell, A., Izgorodina, E. I., Gordon, M. S. & Barca, G. M. J., 28 Jul 2023, In: Journal of Chemical Physics. 159, 4, 24 p., 044112.

    Research output: Contribution to journal › Article › peer-review

    29 Citations (Scopus)

  • Enabling Large-Scale Correlated Electronic Structure Calculations: Scaling the RI-MP2 Method on Summit

    Barca, G. M. J., Galvez Vallejo, J. L., Poole, D. L., Alkan, M., Stocks, R., Rendell, A. P. & Gordon, M. S., 14 Nov 2021, Proceedings of SC 2021: The International Conference for High Performance Computing, Networking, Storage and Analysis: Science and Beyond. Institute of Electrical and Electronics Engineers, 13 p. (International Conference for High Performance Computing, Networking, Storage and Analysis, SC).

    Research output: Chapter in Book/Report/Conference proceeding › Conference contribution › peer-review

    Open Access
    22 Citations (Scopus)

  • Faster Self-Consistent Field (SCF) Calculations on GPU Clusters

    Barca, G. M. J., Alkan, M., Galvez-Vallejo, J. L., Poole, D. L., Rendell, A. P. & Gordon, M. S., 14 Dec 2021, In: Journal of Chemical Theory and Computation. 17, 12, p. 7486-7503 18 p.

    Research output: Contribution to journal › Article › peer-review

    48 Citations (Scopus)
View all 129 research outputs