James Emil Avery

James Emil Avery

Associate Professor

ORCID: 0000-0001-7772-3440

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  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 journal › Conference article › Research › peer-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 journal › Journal article › Research › peer-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 journal › Journal article › Research › peer-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 journal › Journal article › Research › peer-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 journal › Journal article › Research › peer-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 proceeding › Book chapter › Research › peer-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, B., 2016, In : Lecture notes in computer science. 2016, p. 451-469 19 p.

    Research output: Contribution to journal › Conference article › Research › peer-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 journal › Journal article › Research › peer-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 journal › Journal article › Research › peer-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 journal › Journal article › Research › peer-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 proceeding › Book chapter › Research › peer-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 proceeding › Article in proceedings › Research

  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 journal › Journal article › Research › peer-review

  14. Generalized Sturmians and Atomic Spectra

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

    Research output: Book/Report › Book › Research › peer-review

  15. Published

    Hyperspherical Harmonics and Their Physical Applications

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

    Research output: Book/Report › Book › Research › peer-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 journal › Journal article › Research › peer-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 proceeding › Article in proceedings › Research › peer-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 proceeding › Book chapter › Research › peer-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 journal › Journal article › Research › peer-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 journal › Journal article › Research › peer-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 journal › Journal article › Research › peer-review

  22. Published

    New Computational Methods in the Quantum Theory of Nano-Structures

    Avery, James Emil, 2011, University of Copenhagen.

    Research output: Book/Report › Ph.D. thesis › Research

  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 journal › Journal article › Research › peer-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, 14 p., 012512.

    Research output: Contribution to journal › Journal article › Research › peer-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 journal › Journal article › Research › peer-review

  26. Published

    Simulating fullerene polyhedral formation from planar precursors

    Heuser, B., Mikkelsen, Kurt Valentin & Avery, James Emil, 21 Mar 2021, In : Physical Chemistry Chemical Physics. 23, 11, p. 6561-6573 13 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  27. Published

    Size-change termination and bound analysis

    Avery, James Emil, 2006, Functional and Logic Programming: 8th International Symposium, FLOPS 2006, Fuji-Susono, Japan, April 24-26, 2006. Proceedings. Hagiya, M. & Wadler, P. (eds.). Springer, p. 192-207 16 p. (Lecture notes in computer science, Vol. 3945).

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

  28. Published

    Static Complexity Analysis of Higher Order Programs

    Avery, James Emil, Kristiansen, L. & Moyen, J., 2009, FOPARA 2009: Preliminary Proceedings. van Eekelen, M. & Olha, S. (eds.). p. 34-49 16 p.

    Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research

  29. Published

    Static complexity analysis of higher order programs

    Avery, James Emil, Kristiansen, L. & Moyen, J., 2010, Foundational and Practical Aspects of Resource Analysis: First International Workshop, FOPARA 2009, Eindhoven, The Netherlands, November 6, 2009, Revised Selected Papers. van Eekelen, M. & Shkaravska, O. (eds.). Springer, p. 84-99 16 p. (Lecture notes in computer science, Vol. 6324).

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

  30. Published

    Structure and Properties of the Nonface-Spiral Fullerenes T-C380, D3-C384, D3-C440, and D3-C672 and Their Halma and Leapfrog Transforms

    Wirz, L., Tonner, R., Avery, James Emil & Schwerdtfeger, P., 6 Dec 2013, In : Journal of Chemical Information and Modeling. 54, 1, p. 121-130

    Research output: Contribution to journal › Journal article › Research › peer-review

  31. Published

    Sturmians and generalized sturmians in quantum theory

    Avery, J. S. & Avery, James Emil, 2012, Molecular electronic structures of transition metal complexes II. Mingos, D. M. P., Day, P. & Dahl, J. P. (eds.). Springer, p. 53-99 47 p. (Structure and Bonding, Vol. 143).

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

  32. Published

    Symmetry Adapted Basis Sets: Automatic Generation for Problems in Chemistry and Physics

    Avery, J. S., Rettrup, S. & Avery, James Emil, 1 Oct 2011, World Scientific. 256 p.

    Research output: Book/Report › Book › Research › peer-review

  33. Published

    The Generalized Sturmian Method

    Avery, James Emil & Popelier, P. (ed.), 1 Nov 2011, Solving the Schrödinger Equation: Has Everything Been Tried?. Imperial College Press, 34 p.

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

  34. Published

    The generalized sturmian method for calculating spectra of atoms and ions

    Avery, James Emil & Avery, J. S., 2003, In : Journal of Mathematical Chemistry. 33, p. 145-162

    Research output: Contribution to journal › Journal article › Research › peer-review

  35. Published

    The topology of fullerenes

    Schwerdtfeger, P., Wirz, L. & Avery, James Emil, 1 Nov 2014, In : Wiley Interdisciplinary Reviews: Computational Molecular Science. 5, 1, p. 96-145

    Research output: Contribution to journal › Journal article › Research › peer-review

  36. Published

    Toward quantum-chemical method development for arbitrary basis functions

    Herbst, M. F., Dreuw, A. & Avery, James Emil, 28 Aug 2018, In : Journal of Chemical Physics. 149, 8, 15 p., 084106.

    Research output: Contribution to journal › Journal article › Research › peer-review

  37. Published

    Visualizing Automorphisms of Graph Algebras

    Avery, James Emil, Johansen, R. & Szymanski, W., 11 Feb 2018, In : Proceedings of the Edinburgh Mathematical Society. 61, 1, p. 215-249 35 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  38. Published

    Wave Equations Without Coordinates I: Fullerenes

    Avery, James Emil, 2 Sep 2018, In : Rendiconti Lincei. Scienze Fisiche e Naturali. 29, 3, p. 609-621

    Research output: Contribution to journal › Journal article › Research › peer-review

ID: 2819