James Emil Avery
Associate Professor
Xray and Neutron Science
Universitetsparken 5, 2100 København Ø
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4-center STO interelectron repulsion integrals with Coulomb Sturmians. / Avery, James Emil; Avery, John Scales.
In: Advances in Quantum Chemistry, Vol. 76, 2018, p. 133-146.Research output: Contribution to journal › Conference article › Research › peer-review
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A chainlike relative coordinate system for few-particle problems. / Avery, James Emil; Avery, John Scales.
In: Journal of Mathematical Chemistry, Vol. 55, No. 2, 2017, p. 584-597.Research output: Contribution to journal › Journal article › Research › peer-review
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Array streaming for array programming. / Kristensen, Mads R. B.; Avery, James E.
In: International Journal of Computational Science and Engineering, Vol. 17, No. 3, 01.02.2018, p. 263-282.Research output: Contribution to journal › Journal article › Research › peer-review
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Atomic Densities, Polarizabilities, and Natural Orbitals Derived from Generalized Sturmian Calculations. / Avery, John Scales; Avery, James Emil; Aquilanti, Vincenzo; Caligiana, Andrea.
In: Advances in Quantum Chemistry, Vol. 47, 2004, p. 157-176.Research output: Contribution to journal › Journal article › Research › peer-review
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Atomic core-ionization energies; approximately piecewise-linear and linear relationships. / Avery, James Emil; Avery, John Scales.
In: Journal of Mathematical Chemistry, Vol. 46, No. 1, 05.08.2008, p. 164-181.Research output: Contribution to journal › Journal article › Research › peer-review
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Autoionizing states of atoms calculated using generalized sturmians. / Avery, James Emil; Avery, John Scales.
Advances in quantum chemistry. ed. / John R. Sabin; Errki J. Brändas. Academic Press, 2005. p. 103-119 (Advances in Quantum Chemistry, Vol. 49).Research output: Chapter in Book/Report/Conference proceeding › Book chapter › Research › peer-review
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Battling memory requirements of array programming through streaming. / Kristensen, Mads Ruben Burgdorff; Avery, James Emil; Blum, Troels; Lund, Simon Andreas Frimann; Vinter, Brian.
In: Lecture notes in computer science, Vol. 2016, 2016, p. 451-469.Research output: Contribution to journal › Conference article › Research › peer-review
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Can Coulomb Sturmians Be Used as a Basis for N-Electron Molecular Calculations? / Avery, John Scales; Avery, James Emil.
In: Journal of Physical Chemistry A, Vol. 113, No. 52, 06.10.2009, p. 14565–14572.Research output: Contribution to journal › Journal article › Research › peer-review
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Chains, antichains, and complements in infinite partition lattices. / Avery, James Emil; Moyen, Jean-Yves; Ruzicka, Pavel; Simonsen, Jakob Grue.
In: Algebra Universalis, Vol. 79, No. 37, 37, 2018.Research output: Contribution to journal › Journal article › Research › peer-review
Coulomb Sturmians as a basis for molecular calculations. / Avery, John Scales; Avery, James Emil.
In: Molecular Physics, Vol. 110, No. 15-16, 2012, p. 1593-1608.Research output: Contribution to journal › Journal article › Research › peer-review
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Fast Electron Repulsion Integrals for Molecular Coulomb Sturmians. / Avery, James Emil.
Advances in Quantum Chemistry,: PROCEEDINGS OF MEST 2012: EXPONENTIAL TYPE ORBITALS FOR MOLECULAR ELECTRONIC STRUCTURE THEORY. Vol. 67 2013. p. 129-151 (Advances in Quantum Chemistry).Research output: Chapter in Book/Report/Conference proceeding › Book chapter › Research › peer-review
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Fusion of parallel array operations. / Kristensen, Mads Ruben Burgdorff; Lund, Simon Andreas Frimann; Blum, Troels; Avery, James Emil.
PACT' 16: Proceedings of the 2016 International Conference on Parallel Architectures and Compilation. Association for Computing Machinery, 2016. p. 71-85.Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research
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Generalized Sturmian Solutions for Many-Particle Schrödinger Equations. / Avery, John; Avery, James Emil.
In: Journal of Physical Chemistry A, No. 108 (41: Gert D. Billing Memorial Issue), 2004, p. 8848-8851.Research output: Contribution to journal › Journal article › Research › peer-review
Generalized Sturmians and Atomic Spectra. / Avery, James Emil; Avery, John.
1 ed. World Scientific, 2006. 240 p.Research output: Book/Report › Book › Research › peer-review
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Hyperspherical Harmonics and Their Physical Applications. / Avery, James Emil; Avery, John Scales.
Singapore : World Scientific, 2017. 300 p.Research output: Book/Report › Book › Research › peer-review
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Kramers Pairs in configuration interaction. / Avery, John Scales; Avery, James Emil.
In: Advances in Quantum Chemistry, Vol. 43, 2003, p. 185–206.Research output: Contribution to journal › Journal article › Research › peer-review
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Molecular integrals for exponential-type orbitals using hyperspherical harmonics. / Avery, James Emil; Avery, John Scales.
Advances in quantum chemistry. Elsevier, 2015. p. 265-324 (Advances in Quantum Chemistry, Vol. 70).Research output: Chapter in Book/Report/Conference proceeding › Book chapter › Research › peer-review
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Molecular integrals for slater type orbitals using coulomb sturmians. / Avery, James Emil; Avery, John Scales.
In: Journal of Mathematical Chemistry, Vol. 52, No. 1, 12.01.2014, p. 301-312.Research output: Contribution to journal › Journal article › Research › peer-review
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Naming polyhedra by general face-spirals : theory and applications to fullerenes and other polyhedral molecules. / Wirz, Lukas; Schwerdtfeger, Peter; Avery, James Emil.
In: Fullerenes Nanotubes and Carbon Nanostructures, Vol. 26, No. 10, 03.10.2018, p. 607-630.Research output: Contribution to journal › Journal article › Research › peer-review
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Natural Orbitals from Generalized Sturmian Calculations. / Avery, John Scales; Avery, James Emil.
In: Advances in Quantum Chemistry, Vol. 43, 2003, p. 207-216.Research output: Contribution to journal › Journal article › Research › peer-review
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New Computational Methods in the Quantum Theory of Nano-Structures. / Avery, James Emil.
University of Copenhagen, 2011.Research output: Book/Report › Ph.D. thesis › Research
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Program Fullerene : a software package for constructing and analyzing structures of regular fullerenes. / Wirz, Lukas; Peter, Schwerdtfeger,; Avery, James Emil.
In: Journal of Computational Chemistry, Vol. 34, No. 17, 04.04.2013, p. 1508-1526.Research output: Contribution to journal › Journal article › Research › peer-review
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Rapid evaluation of molecular integrals with ETOs. / Avery, John Scales; Avery, James Emil.
In: International Journal of Quantum Chemistry, Vol. 115, No. 15, 05.08.2015, p. 930-936.Research output: Contribution to journal › Journal article › Research › peer-review
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Size-change termination and bound analysis. / Avery, James Emil.
Functional and Logic Programming: 8th International Symposium, FLOPS 2006, Fuji-Susono, Japan, April 24-26, 2006. Proceedings. ed. / Masami Hagiya; Philip Wadler. Springer, 2006. p. 192-207 (Lecture notes in computer science, Vol. 3945).Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research › peer-review
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Static Complexity Analysis of Higher Order Programs. / Avery, James Emil; Kristiansen, Lars; Moyen, Jean-Yves.
FOPARA 2009: Preliminary Proceedings. ed. / Marko van Eekelen; Shkaravska Olha. 2009. p. 34-49.Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research
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Static complexity analysis of higher order programs. / Avery, James Emil; Kristiansen, Lars; Moyen, Jean-Yves.
Foundational and Practical Aspects of Resource Analysis: First International Workshop, FOPARA 2009, Eindhoven, The Netherlands, November 6, 2009, Revised Selected Papers. ed. / Marko van Eekelen; Olha Shkaravska. Springer, 2010. p. 84-99 (Lecture notes in computer science, Vol. 6324).Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research › peer-review
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Structure and Properties of the Nonface-Spiral Fullerenes T-C380, D3-C384, D3-C440, and D3-C672 and Their Halma and Leapfrog Transforms. / Wirz, Lukas; Tonner, Ralf; Avery, James Emil; Schwerdtfeger, Peter.
In: Journal of Chemical Information and Modeling, Vol. 54, No. 1, 06.12.2013, p. 121-130.Research output: Contribution to journal › Journal article › Research › peer-review
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Sturmians and generalized sturmians in quantum theory. / Avery, John Scales; Avery, James Emil.
Molecular electronic structures of transition metal complexes II. ed. / David Michael P. Mingos; Peter Day; Jens Peder Dahl. Springer, 2012. p. 53-99 (Structure and Bonding, Vol. 143).Research output: Chapter in Book/Report/Conference proceeding › Book chapter › Research › peer-review
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Symmetry Adapted Basis Sets : Automatic Generation for Problems in Chemistry and Physics. / Avery, John Scales; Rettrup, Sten; Avery, James Emil.
World Scientific, 2011. 256 p.Research output: Book/Report › Book › Research › peer-review
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The Generalized Sturmian Method. / Avery, James Emil; Popelier, Paul (Editor).
Solving the Schrödinger Equation: Has Everything Been Tried?. Imperial College Press, 2011.Research output: Chapter in Book/Report/Conference proceeding › Book chapter › Research › peer-review
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The generalized sturmian method for calculating spectra of atoms and ions. / Avery, James Emil; Avery, John Scales.
In: Journal of Mathematical Chemistry, Vol. 33, 2003, p. 145-162.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
The topology of fullerenes. / Schwerdtfeger, Peter; Wirz, Lukas; Avery, James Emil.
In: Wiley Interdisciplinary Reviews: Computational Molecular Science, Vol. 5, No. 1, 01.11.2014, p. 96-145.Research output: Contribution to journal › Journal article › Research › peer-review
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Toward quantum-chemical method development for arbitrary basis functions. / Herbst, Michael F.; Dreuw, Andreas; Avery, James Emil.
In: Journal of Chemical Physics, Vol. 149, No. 8, 084106, 28.08.2018.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Visualizing Automorphisms of Graph Algebras. / Avery, James Emil; Johansen, Rune; Szymanski, Wojciech.
In: Proceedings of the Edinburgh Mathematical Society, Vol. 61, No. 1, 11.02.2018, p. 215-249.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Wave Equations Without Coordinates I : Fullerenes. / Avery, James Emil.
In: Rendiconti Lincei. Scienze Fisiche e Naturali, Vol. 29, No. 3, 02.09.2018, p. 609-621.Research output: Contribution to journal › Journal article › Research › peer-review
ID: 2819
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The topology of fullerenes
Research output: Contribution to journal › Journal article › Research › peer-review
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Naming polyhedra by general face-spirals: theory and applications to fullerenes and other polyhedral molecules
Research output: Contribution to journal › Journal article › Research › peer-review
Published