Publications obtained by using VSC

Here are the scientific Publications of the various Projects on the VSC, while a collection of interesting articles for the general audience can be found in the main menu at Presscorner.
 



859 entries found
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  • Rovigatti Lorenzo, Capone Barbara, Likos Christos N.
    Soft self-assembled nanoparticles with temperature-dependent properties
    NANOSCALE 8, 3288 (2016)
  • Mewes Stefanie A., Mewes Jan-Michael, Dreuw Andreas, Plasser Felix
    Excitons in poly(para phenylene vinylene): a quantum-chemical perspective based on high-level ab initio calculations
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS 18, 2548 (2016)
  • Camargo F., Whalen J. D., Ding R., Sadeghpour H. R., Yoshida S., Burgdoerfer J., Dunning F. B., Killian T. C.
    Lifetimes of ultra-long-range strontium Rydberg molecules
    PHYSICAL REVIEW A 93, 022702 (2016)
  • Kicuntod Jintawee, Khuntawee Wasinee, Wolschann Peter, Pongsawasdi Piamsook, Chavasiri Warinthorn, Kungwan Nawee, Rungrotmongkol Thanyada
    Inclusion complexation of pinostrobin with various cyclodextrin derivatives
    JOURNAL OF MOLECULAR GRAPHICS & MODELLING 63, 91 (2016)
  • Aquilante Francesco, Autschbach Jochen, Carlson Rebecca K., Chibotaru Liviu F., Delcey Mickael G., De Vico Luca, Galvan Ignacio Fdez, Ferre Nicolas, Frutos Luis Manuel, Gagliardi Laura, Garavelli Marco, Giussani Angelo, Hoyer Chad E., Li Manni Giovanni, L
    Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table
    JOURNAL OF COMPUTATIONAL CHEMISTRY 37, 506 (2016)
  • Wissgott Philipp, Held Karsten
    Electronic structure of CeRu4Sn6: a density functional plus dynamical mean field theory study
    EUROPEAN PHYSICAL JOURNAL B 89, 5 (2016)
  • Held M., Wiesenberger M., Stegmeir A.
    Three discontinuous Galerkin schemes for the anisotropic heat conduction equation on non-aligned grids
    COMPUTER PHYSICS COMMUNICATIONS 199, 29 (2016)
  • Schaefer Thomas, Toschi Alessandro, Held Karsten
    Dynamical vertex approximation for the two-dimensional Hubbard model
    JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS 400, 107 (2016)
  • Muthsam, Herbert J., Kupka, Friedrich
    Multidimensional modelling of classical pulsating stars
    Konkoly Observatory, Budapest
  • Bancelin, D.; Pilat-Lohinger, E.; Bazsó, Á.
    Asteroid flux towards circumprimary habitable zones in binary star systems. II. Dynamics
    EDP Sciences
  • Marco Seifried, Christian Knoll, Gerald Giester, Michael Reissner, Danny Müller and Peter Weinberger
    Hexakis(propargyl-1H-tetrazole)Iron(II)X2 [X=BF4, ClO4] - Spin Switchable Complexes with Functionalization Potential and the Myth of the Explosive SCO Compound
    MDPI
  • Josef Weinbub, Andreas Hössinger
    Comparison of the Parallel Fast Marching Method, the Fast Iterative Method, and the Parallel Semi-ordered Fast Iterative Method
    Procedia Computer Science, Elsevier
  • Pavel Ondra?ka, David Holec, David Ne?as and Lenka Zají?ková
    Accurate prediction of band gaps and optical properties of HfO2
    IOP Publishing, Journal of Physics D: Applied Physics, Volume 49, Number 39
  • M. Held, M. Wiesenberger, J. Madsen and A. Kendl
    The influence of temperature dynamics and dynamic finite ion Larmor radius effects on seeded high amplitude plasma blobs
    IOPSCIENCE, Nuclear Fusion
  • Vladimir L. Kalashnikov, Sergey Sergeyev
    Stochastic Calculations for Fibre Raman Amplifiers with Randomly Varying Birefringence, Chaotic Modeling and Simulation, January 2016 Issue, pp. 52-59.
    CMSIM
  • V.L. Kalashnikov, S.V. Sergeyev
    Stochastic Anti-Resonance in Polarization Phenomena, Chapter 10 in The Foundations of Chaos Revisited: From Poincaré to Recent Advancements, Ch. Skiadas (Ed.), pp. 159-179
    Springer
  • Freddy Florez
    Air entrainment in free falling water jets
    Wien
    VSC project: 70470
  • Josef Weinbub, Andreas Hössinger
    Shared-Memory Parallelization of the Fast Marching Method Using an Overlapping Domain-Decomposition Approach
    High Performance Computing Symposium, ACM
  • A. Morhammer, K. Rupp, F. Rudolf, J. Weinbub
    Optimized Sparse Matrix-Matrix Multiplication for Multi-Core CPUs, GPUs and MICs
    Austrian HPC Meeting 2016
    VSC project: 70769
  • DeSalvo B. J., Aman J. A., Dunning F. B., Killian T. C., Sadeghpour H. R., Yoshida S., Burgdoerfer J.
    Ultra-long-range Rydberg molecules in a divalent atomic system
    PHYSICAL REVIEW A 92, 1403 (2015)
    VSC project: 70364
  • Feldbauer G., Wolloch M., Bedolla P. O., Mohn P., Redinger J., Vernes A.
    Adhesion and material transfer between contacting Al and TiN surfaces from first principles
    PHYSICAL REVIEW B 91, 5413 (2015)
    VSC project: 70261
  • Nogueira Juan J., Oppel Markus, Gonzalez Leticia
    Enhancing Intersystem Crossing in Phenotiazinium Dyes by Intercalation into DNA
    ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 54, 4375 (2015)
    VSC project: 70570
  • Flouri T., Izquierdo-Carrasco F., Darriba D., Aberer A. J., Nguyen L. -T., Minh B. Q., Von Haeseler A., Stamatakis A.
    The Phylogenetic Likelihood Library
    SYSTEMATIC BIOLOGY 64, 356 (2015)
    VSC project: 70332
  • Crespo-Hernandez Carlos E, Martinez-Fernandez Lara, Rauer Clemens, Reichardt Christian, Mai Sebastian, Pollum Marvin, Marquetand Philipp, Gonzalez Leticia, Corral Ines
    Electronic and structural elements that regulate the excited-state dynamics in purine nucleobase derivatives.
    Journal of the American Chemical Society 137, 4368 (2015)
  • Jungblut Swetlana, Dellago Christoph
    Caveats of mean first-passage time methods applied to the crystallization transition: Effects of non-Markovianity.
    The Journal of chemical physics 142, 064103 (2015)
  • Sterflinger Katja, Lopandic Ksenija, Blasi Barbara, Poynter Caroline, de Hoog Sybren, Tafer Hakim
    Draft Genome of Cladophialophora immunda, a Black Yeast and Efficient Degrader of Polyaromatic Hydrocarbons.
    Genome announcements 3, (2015)
  • Weinbub Josef, Ellinghaus Paul, Selberherr Siegfried
    Parallelization of the Two-Dimensional Wigner Monte Carlo Method
    LARGE-SCALE SCIENTIFIC COMPUTING, LSSC 2015 9374, 309 (2015)
  • Ghosh Joydeep, Osintsev Dmitry, Sverdlov Viktor, Weinbub Josef, Selberherr Siegfried
    Evaluation of Spin Lifetime in Thin-Body FETs: A High Performance Computing Approach
    LARGE-SCALE SCIENTIFIC COMPUTING, LSSC 2015 9374, 285 (2015)
  • Sangpheak Waratchada, Kicuntod Jintawee, Schuster Roswitha, Rungrotmongkol Thanyada, Wolschann Peter, Kungwan Nawee, Viernstein Helmut, Mueller Monika, Pongsawasdi Piamsook
    Physical properties and biological activities of hesperetin and naringenin in complex with methylated beta-cyclodextrin
    BEILSTEIN JOURNAL OF ORGANIC CHEMISTRY 11, 2763 (2015)
  • Thesberg Mischa, Pourfath Mahdi, Kosina Hans, Neophytou Neophytos
    The influence of non-idealities on the thermoelectric power factor of nanostructured superlattices
    JOURNAL OF APPLIED PHYSICS 118, 224301 (2015)

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