Plato: A localised orbital based density functional theory code (English)
- New search for: Kenny, S.D.
- New search for: Kenny, S.D.
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In:
Computer physics communications
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180
, 12
; 2616-2622
;
2009
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ISSN:
- Article (Journal) / Print
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Title:Plato: A localised orbital based density functional theory code
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Contributors:Kenny, S.D. ( author ) / Horsfield, A.P.
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Published in:Computer physics communications ; 180, 12 ; 2616-2622
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Publisher:
- New search for: North Holland Publ. Co.
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Place of publication:Amsterdam
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Publication date:2009
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ISSN:
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ZDBID:
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Type of media:Article (Journal)
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Type of material:Print
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Language:English
- New search for: 54.80 / 33.06
- Further information on Basic classification
- New search for: 535/3125/3155
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Keywords:
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Classification:
BKL: 54.80 Angewandte Informatik / 33.06 Mathematische Methoden der Physik Local classification TIB: 535/3125/3155 -
Source:
Table of contents – Volume 180, Issue 12
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 2401
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ALTDSE: An Arnoldi–Lanczos program to solve the time-dependent Schrödinger equationGuan, Xiaoxu / Noble, C.J. / Zatsarinny, O. / Bartschat, K. / Schneider, B.I. et al. | 2009
- 2401
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ALTDSE: An Arnoldi-Lanczos program to solve the time-dependent Schrodinger equationGuan, X. / Noble, C. J. / Zatsarinny, O. / Bartschat, K. / Schneider, B. I. et al. | 2009
- 2410
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‘tripleint_cc’: A program for 2-centre variational leptonic Coulomb potential matrix elements using Hylleraas-type trial functions, with a performance optimization studyPlummer, M. / Armour, E.A.G. / Todd, A.C. / Franklin, C.P. / Cooper, J.N. et al. | 2009
- 2424
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2DRMP: A suite of two-dimensional R-matrix propagation codesScott, N.S. / Scott, M.P. / Burke, P.G. / Stitt, T. / Faro-Maza, V. / Denis, C. / Maniopoulou, A. et al. | 2009
- 2450
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FARM_2DRMP: A version of FARM for use with 2DRMPBurke, V.M. / Noble, C.J. / Faro-Maza, V. / Maniopoulou, A. / Scott, N.S. et al. | 2009
- 2452
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Chaste: A test-driven approach to software development for biological modellingPitt-Francis, Joe / Pathmanathan, Pras / Bernabeu, Miguel O. / Bordas, Rafel / Cooper, Jonathan / Fletcher, Alexander G. / Mirams, Gary R. / Murray, Philip / Osborne, James M. / Walter, Alex et al. | 2009
- 2472
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MonALISA: An agent based, dynamic service system to monitor, control and optimize distributed systemsLegrand, I. / Newman, H. / Voicu, R. / Cirstoiu, C. / Grigoras, C. / Dobre, C. / Muraru, A. / Costan, A. / Dediu, M. / Stratan, C. et al. | 2009
- 2499
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ROOT — A C++ framework for petabyte data storage, statistical analysis and visualizationAntcheva, I. / Ballintijn, M. / Bellenot, B. / Biskup, M. / Brun, R. / Buncic, N. / Canal, Ph. / Casadei, D. / Couet, O. / Fine, V. et al. | 2009
- 2513
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Virtualizing access to scientific applications with the Application Hosting EnvironmentZasada, S.J. / Coveney, P.V. et al. | 2009
- 2526
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Accelerating scientific computations with mixed precision algorithmsBaboulin, Marc / Buttari, Alfredo / Dongarra, Jack / Kurzak, Jakub / Langou, Julie / Langou, Julien / Luszczek, Piotr / Tomov, Stanimire et al. | 2008
- 2534
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HONEI: A collection of libraries for numerical computations targeting multiple processor architecturesvan Dyk, Danny / Geveler, Markus / Mallach, Sven / Ribbrock, Dirk / Göddeke, Dominik / Gutwenger, Carsten et al. | 2009
- 2544
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SCELib3.0: The new revision of SCELib, the parallel computational library of molecular properties in the Single Center ApproachSanna, N. / Baccarelli, I. / Morelli, G. et al. | 2009
- 2550
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The VOLSCAT package for electron and positron scattering of molecular targets: A new high throughput approach to cross-section and resonances computationSanna, N. / Baccarelli, I. / Morelli, G. et al. | 2009
- 2563
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A Hardware-Accelerated Quantum Monte Carlo framework (HAQMC) for N-body systemsGothandaraman, Akila / Peterson, Gregory D. / Warren, G. Lee / Hinde, Robert J. / Harrison, Robert J. et al. | 2009
- 2574
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HASPRNG: Hardware Accelerated Scalable Parallel Random Number GeneratorsLee, JunKyu / Bi, Yu / Peterson, Gregory D. / Hinde, Robert J. / Harrison, Robert J. et al. | 2009
- 2582
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ABINIT: First-principles approach to material and nanosystem propertiesGonze, X. / Amadon, B. / Anglade, P.-M. / Beuken, J.-M. / Bottin, F. / Boulanger, P. / Bruneval, F. / Caliste, D. / Caracas, R. / Côté, M. et al. | 2009
- 2616
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Plato: A localised orbital based density functional theory codeKenny, S.D. / Horsfield, A.P. et al. | 2009
- 2622
-
PHON: A program to calculate phonons using the small displacement methodAlfè, Dario et al. | 2009
- 2634
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FILMPAR: A parallel algorithm designed for the efficient and accurate computation of thin film flow on functional surfaces containing micro-structureLee, Y.C. / Thompson, H.M. / Gaskell, P.H. et al. | 2009
- 2650
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The nonlinear gyro-kinetic flux tube code GKWPeeters, A.G. / Camenen, Y. / Casson, F.J. / Hornsby, W.A. / Snodin, A.P. / Strintzi, D. / Szepesi, G. et al. | 2009
- 2673
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Parallel programming interface for distributed dataWang, Manhui / May, Andrew J. / Knowles, Peter J. et al. | 2009
- 2680
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Simulation of electron spin resonance spectroscopy in diverse environments: An integrated approachZerbetto, Mirco / Polimeno, Antonino / Barone, Vincenzo et al. | 2009
- 2698
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Automated generation of lattice QCD Feynman rulesHart, A. / von Hippel, G.M. / Horgan, R.R. / Müller, E.H. et al. | 2009
- 2717
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tmLQCD: A program suite to simulate Wilson twisted mass lattice QCDJansen, Karl / Urbach, Carsten et al. | 2009
- 2739
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The BAGEL assembler generation libraryBoyle, Peter A. et al. | 2009
- IFC
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Editorial Board| 2009
- iii
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Computer Physics Communications| 2009
- iv
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Figure captions| 2009
- ix
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Contents| 2009
- v
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ForewordScott, N. Stanley et al. | 2009
- vii
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Establishment of CPC and the Program LibraryBurke, Phil / Burke, Val et al. | 2009