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.
 

1154 entries found
with the tags:
  • Rauer Clemens, Nogueira Juan J., Marquetand Philipp, Gonzalez Leticia
    Stepwise photosensitized thymine dimerization mediated by an exciton intermediate
    MONATSHEFTE FUR CHEMIE 149, 1 (2018)
  • Wan-Wendner Lin, Wan-Wendner Roman, Cusatis Gianluca
    Age-dependent size effect and fracture characteristics of ultra-high performance concrete
    CEMENT & CONCRETE COMPOSITES 85, 67 (2018)
  • Aliaksandr Hubin, Geir Storvik, Florian Frommlet
    A Novel Algorithmic Approach to Bayesian Logic Regression
    Bayesian Analysis
  • Müller Danny, Knoll Christian, Ruh Thomas, Artner Werner, Welch Jan M., Peterlik Herwig, Eitenberger Elisabeth, Friedbacher Gernot, Harasek Michael, Blaha Peter, Hradil Klaudia, Werner Andreas, Weinberger Peter
    Calcium Doping Facilitates Water Dissociation in Magnesium Oxide
    ADVANCED SUSTAINABLE SYSTEMS 2, 1700096 (2018)
  • Höfinger Siegfried, Ruh Thomas, Haunschmid Ernst
    Fast Approximate Evaluation of Parallel Overhead from a Minimal Set of Measured Execution Times
    PARALLEL PROCESSING LETTERS 28, 1850003 (2018)
  • F. Kraushofer, Z. Jakub, M. Bichler, J. Hulva, P. Drmota, M. Weinold, M. Schmid, M. Setvin, U. Diebold, P. Blaha, G. Parkinson:
    Atomic-Scale Structure of the Hematite ?-Fe2O3(1102) "R-Cut" Surface
    The Journal of Physical Chemistry C, 122 (2018), 1657 - 1669.
    VSC project: 70296
  • F. Tran, S. Ehsan, P. Blaha:
    Assessment of the GLLB-SC potential for solid-state properties and attempts for improvement
    Physical Review Materials, 2 (2018), 023802.
    VSC project: 70296
  • S. Ehsan, A. Tröster, F. Tran, P. Blaha:
    DFT study of the electronic properties and the cubic to tetragonal phase transition in RbCaF3
    Physical Review Materials, 2 (2018), 093610.
    VSC project: 70296
  • F. Tran, P. Kovacs, L. Kalantari, G.K.H. Madsen, P. Blaha:
    Orbital-free approximations to the kinetic-energy density in exchange-correlation MGGA functionals: Tests on solids"
    Journal of Chemical Physics, 149 (2018), 144105.
    VSC projects: 70296, 71212
  • F. Karsai, M. Humer, E. Flage-Larsen, P. Blaha, G. Kresse:
    Effects of electron-phonon coupling on absorption spectrum: K edge of hexagonal boron nitride
    Physical Review B, 98 (2018), 235205.
    VSC project: 70296
  • Coppola, E., S. Sobolowski, E. Pichelli, F. Raffaele, B. Ahrens, I. Anders, N. Ban, S. Bastin, M. Belda, D. Belusic, A. Caldas-Alvarez, R. M. Cardoso, S. Davolio, A. Dobler, J. Fernandez, L. Fita, Q. Fumiere, F. Giorgi, K. Goergen, I. Güttler, T. Halenka,
    A first-of-its-kind multi-model convection permitting ensemble for investigating convective phenomena over Europe and the Mediterranean
    Climate Dynamics
  • Freddy Florez, Reinhard Prenner, Norbert Krouzecky
    Experimental and numerical investigations of water jets
    Materials Today: Proceedings. Ed. Elsevier
  • Pascal Törek, Axel Maas
    On observable particles in theories with a Brout-Englert-Higgs effect
    Proceedings of Science
  • Pascal Törek, Axel Maas, René Sondenheimer
    A study of how the particle spectra of SU(N) gauge theories with a fundamental Higgs emerge
    Springer
  • Faulhuber Markus
    A short note on the frame set of odd functions
    Cambridge University Press
  • D. Prenner

    Wiley
  • Schindelegger M., Green J.A.M., Wilmes S.-B., Haigh I.D.
    Can we model the effect of observed sea level rise on tides?
    Journal of Geophysical Research Oceans
  • Emanuele Locatelli, Lorenzo Rovigatti
    An Accurate Estimate of the Free Energy and Phase Diagram of All-DNA Bulk Fluids
    MDPI
  • Gualdani R, Cavalluzzi MM, Tadini-Buoninsegni F, Convertino M, Gailly P, Stary-Weinzinger A, Lentini G.
    Molecular Insights into hERG Potassium Channel Blockade by Lubeluzole.
    Cell Physiol Biochem.
  • E. Arrigoni and A. Dorda
    Master Equations Versus Keldysh Green’s Functions for Correlated Quantum Systems Out of Equilibrium.
    Springer
  • Brigitta Goger
    Evaluation of a High-Resolution Numerical Weather Prediction Model in Complex Terrain
    University of Innsbruck
    VSC project: 70673
  • Pascal Törek
    The physical spectrum of theories with a Brout-Englert-Higgs effect
    Univ. Graz
    VSC project: 70847
  • Nerattini Francesca
    Computational protein design
    PhD thesis, University of Vienna (2018)
    VSC project: 70743
  • Singraber Andreas
    Designing and training neural network potentials for molecular dynamics simulations
    PhD thesis, University of Vienna (2018)
    VSC project: 70754
  • Gunacker Patrik
    Continuous-time quantum Monte Carlo in the hybridization expansion: implementations and applications
    PhD thesis, TU Wien (2018)
    VSC project: 70808
  • Bianca Buchner
    Complete enumeration of elementary flux modes in metabolic networks
    FH Campus Wien
    VSC project: 71141
  • Aliaksandr Hubin, Geir Storvik, Florian Frommlet
    Deep Bayesian regression models
    ArXive
    VSC project: 71305
  • Rupp Karl, Rudolf Florian, Weinbub Josef
    Features of ViennaCL in PETSc
    Austrian HPC Meeting 2018
    VSC project: 70769
  • Watson Layne T., Sosonkina Masha, Thacker William, Weinbub Josef, Rupp Karl
    Proceedings of the High Performance Computing Symposium (HPC 2018)
    SpringSim '18 2018 Spring Simulation Multiconference, Society for Computer Simulation International (2018)
  • Zhang Hong, Mills Richard T., Rupp Karl, Smith Barry F.
    Vectorized Parallel Sparse Matrix-Vector Multiplication in PETSc Using AVX-512
    ACM, ICPP 2018 Proceedings of the 47th International Conference on Parallel Processing (2018)

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