James Emil Avery

James Emil Avery

Associate Professor


  1. Published

    4-center STO interelectron repulsion integrals with Coulomb Sturmians

    Avery, James Emil & Avery, J. S., 2018, In : Advances in Quantum Chemistry. 76, p. 133-146 14 p.

    Research output: Contribution to journalConference articleResearchpeer-review

  2. Published

    A chainlike relative coordinate system for few-particle problems

    Avery, James Emil & Avery, J. S., 2017, In : Journal of Mathematical Chemistry. 55, 2, p. 584-597 14 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  3. Published

    Array streaming for array programming

    Kristensen, M. R. B. & Avery, James Emil, 1 Feb 2018, In : International Journal of Computational Science and Engineering. 17, 3, p. 263-282

    Research output: Contribution to journalJournal articleResearchpeer-review

  4. Published

    Atomic Densities, Polarizabilities, and Natural Orbitals Derived from Generalized Sturmian Calculations

    Avery, J. S., Avery, James Emil, Aquilanti, V. & Caligiana, A., 2004, In : Advances in Quantum Chemistry. 47, p. 157-176

    Research output: Contribution to journalJournal articleResearchpeer-review

  5. Published

    Atomic core-ionization energies; approximately piecewise-linear and linear relationships

    Avery, James Emil & Avery, J. S., 5 Aug 2008, In : Journal of Mathematical Chemistry. 46, 1, p. 164-181 17 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  6. Published

    Autoionizing states of atoms calculated using generalized sturmians

    Avery, James Emil & Avery, J. S., 2005, Advances in quantum chemistry. Sabin, J. R. & Brändas, E. J. (eds.). Academic Press, p. 103-119 17 p. (Advances in Quantum Chemistry, Vol. 49).

    Research output: Chapter in Book/Report/Conference proceedingBook chapterResearchpeer-review

  7. Published

    Battling memory requirements of array programming through streaming

    Kristensen, M. R. B., Avery, James Emil, Blum, T., Lund, S. A. F. & Vinter, Brian, 2016, In : Lecture notes in computer science. 2016, p. 451-469 19 p.

    Research output: Contribution to journalConference articleResearchpeer-review

  8. Published

    Can Coulomb Sturmians Be Used as a Basis for N-Electron Molecular Calculations?

    Avery, J. S. & Avery, James Emil, 6 Oct 2009, In : Journal of Physical Chemistry A. 113, 52, p. 14565–14572 8 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  9. Published

    Chains, antichains, and complements in infinite partition lattices

    Avery, James Emil, Moyen, J., Ruzicka, P. & Simonsen, Jakob Grue, 2018, In : Algebra Universalis. 79, 37, 21 p., 37.

    Research output: Contribution to journalJournal articleResearchpeer-review

  10. Coulomb Sturmians as a basis for molecular calculations

    Avery, J. S. & Avery, James Emil, 2012, In : Molecular Physics. 110, 15-16, p. 1593-1608 16 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  11. Published

    Fast Electron Repulsion Integrals for Molecular Coulomb Sturmians

    Avery, James Emil, 2 Jan 2013, Advances in Quantum Chemistry,: PROCEEDINGS OF MEST 2012: EXPONENTIAL TYPE ORBITALS FOR MOLECULAR ELECTRONIC STRUCTURE THEORY. Vol. 67. p. 129-151 (Advances in Quantum Chemistry).

    Research output: Chapter in Book/Report/Conference proceedingBook chapterResearchpeer-review

  12. Published

    Fusion of parallel array operations

    Kristensen, M. R. B., Lund, S. A. F., Blum, T. & Avery, James Emil, 2016, PACT' 16: Proceedings of the 2016 International Conference on Parallel Architectures and Compilation. Association for Computing Machinery, p. 71-85 15 p.

    Research output: Chapter in Book/Report/Conference proceedingArticle in proceedingsResearch

  13. Published

    Generalized Sturmian Solutions for Many-Particle Schrödinger Equations

    Avery, J. & Avery, James Emil, 2004, In : Journal of Physical Chemistry A. 108 (41: Gert D. Billing Memorial Issue), p. 8848-8851

    Research output: Contribution to journalJournal articleResearchpeer-review

  14. Generalized Sturmians and Atomic Spectra

    Avery, James Emil & Avery, J., 2006, 1 ed. World Scientific. 240 p.

    Research output: Book/ReportBookResearchpeer-review

  15. Published

    Hyperspherical Harmonics and Their Physical Applications

    Avery, James Emil & Avery, J. S., 2017, Singapore: World Scientific. 300 p.

    Research output: Book/ReportBookResearchpeer-review

  16. Published

    Kramers Pairs in configuration interaction

    Avery, J. S. & Avery, James Emil, 2003, In : Advances in Quantum Chemistry. 43, p. 185–206 22 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  17. Published

    Lossy channels in Bohrium

    Kristensen, M. R. B. & Avery, James Emil, 2019, Communicating Process Architectures 2017 and 2018, WoTUG-39 and WoTUG-40 - Proceedings of CPA 2017 (WoTUG-39) and Proceedings of CPA 2018 (WoTUG-40). Pedersen, J. B., Chalmers, K., Broenink, J. F., Vinter, B., Vella, K., Welch, P. H., Smith, M. L. & Skovhede, K. (eds.). IMIA and IOS Press, p. 347-360 14 p. (Concurrent Systems Engineering Series, Vol. 70).

    Research output: Chapter in Book/Report/Conference proceedingArticle in proceedingsResearchpeer-review

  18. Published

    Molecular integrals for exponential-type orbitals using hyperspherical harmonics

    Avery, James Emil & Avery, J. S., 2015, Advances in quantum chemistry. Elsevier, p. 265-324 60 p. (Advances in Quantum Chemistry, Vol. 70).

    Research output: Chapter in Book/Report/Conference proceedingBook chapterResearchpeer-review

  19. Published

    Molecular integrals for slater type orbitals using coulomb sturmians

    Avery, James Emil & Avery, J. S., 12 Jan 2014, In : Journal of Mathematical Chemistry. 52, 1, p. 301-312 12 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  20. Published

    Naming polyhedra by general face-spirals: theory and applications to fullerenes and other polyhedral molecules

    Wirz, L., Schwerdtfeger, P. & Avery, James Emil, 3 Oct 2018, In : Fullerenes Nanotubes and Carbon Nanostructures. 26, 10, p. 607-630 24 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  21. Published

    Natural Orbitals from Generalized Sturmian Calculations

    Avery, J. S. & Avery, James Emil, 2003, In : Advances in Quantum Chemistry. 43, p. 207-216

    Research output: Contribution to journalJournal articleResearchpeer-review

  22. Published

    New Computational Methods in the Quantum Theory of Nano-Structures

    Avery, James Emil, 2011, University of Copenhagen.

    Research output: Book/ReportPh.D. thesisResearch

  23. Published

    Program Fullerene: a software package for constructing and analyzing structures of regular fullerenes

    Wirz, L., Peter, S. & Avery, James Emil, 4 Apr 2013, In : Journal of Computational Chemistry. 34, 17, p. 1508-1526 18 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  24. Published

    Quantum chemistry with Coulomb Sturmians: Construction and convergence of Coulomb Sturmian basis sets at the Hartree-Fock level

    Herbst, M. F., Avery, James Emil & Dreuw, A., 18 Jan 2019, In : Physical Review A. 99, 1, 012512.

    Research output: Contribution to journalJournal articleResearchpeer-review

  25. Published

    Rapid evaluation of molecular integrals with ETOs

    Avery, J. S. & Avery, James Emil, 5 Aug 2015, In : International Journal of Quantum Chemistry. 115, 15, p. 930-936

    Research output: Contribution to journalJournal articleResearchpeer-review

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