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.
 



1156 entries found
with the tags:
  • Wolloch M., Feldbauer G., Mohn P., Redinger J., Vernes A.
    Ab initio friction forces on the nanoscale: A density functional theory study of fcc Cu(111)
    PHYSICAL REVIEW B 90, 195418 (2014)
  • Holec D., Tasnadi F., Wagner P., Friak M., Neugebauer J., Mayrhofer P. H., Keckes J.
    Macroscopic elastic properties of textured ZrN-AlN polycrystalline aggregates: From ab initio calculations to grainscale interactions
    PHYSICAL REVIEW B 90, 184106 (2014)
  • Borges Itamar Jr., Aquino Adelia J. A., Lischka Hans
    A Multireference Configuration Interaction Study of the Photodynamics of Nitroethylene
    JOURNAL OF PHYSICAL CHEMISTRY A 118, 12011 (2014)
  • Ivanov A. N., Hoellwieser R., Wellenzohn M., Troitskaya N. I., Berdnikov Ya. A.
    Internal bremsstrahlung of beta decay of atomic S-35(16) (vol 90, 064608, 2014)
    PHYSICAL REVIEW C 90, 069902 (2014)
  • Brambilla N., Eidelman S., Foka P., Gardner S., Kronfeld A. S., Alford M. G., Alkofer R., Butenschoen M., Cohen T. D., Erdmenger J., Fabbietti L., Faber M., Goity J. L., Ketzer B., Lin H. W., Llanes-Estrada F. J., Meyer H. B., Pakhlov P., Pallante E., Pol
    QCD and strongly coupled gauge theories: challenges and perspectives
    EUROPEAN PHYSICAL JOURNAL C 74, 2981 (2014)
  • Nutho Bodee, Khuntawee Wasinee, Rungnim Chompoonut, Pongsawasdi Piamsook, Wolschann Peter, Karpfen Alfred, Kungwan Nawee, Rungrotmongkol Thanyada
    Binding mode and free energy prediction of fisetin/beta-cyclodextrin inclusion complexes
    BEILSTEIN JOURNAL OF ORGANIC CHEMISTRY 10, 2789 (2014)
  • Kiss Peter T., Sega Marcello, Baranyai Andras
    Efficient Handling of Gaussian Charge Distributions: An Application to Polarizable Molecular Models
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION 10, 5513 (2014)
  • Bliem R., McDermott E., Ferstl P., Setvin M., Gamba O., Pavelec J., Schneider M. A., Schmid M., Diebold U., Blaha P., Hammer L., Parkinson G. S.
    Subsurface cation vacancy stabilization of the magnetite (001) surface
    SCIENCE 346, 1215 (2014)
  • Kalashnikov Vladimir L., Sorokin Evgeni
    Dissipative Raman Solitons
    OPTICS EXPRESS 22, 30118 (2014)
  • Schoenhart Martin, Mitter Hermine, Schmid Erwin, Heinrich Georg, Gobiet Andreas
    Integrated Analysis of Climate Change Impacts and Adaptation Measures in Austrian Agriculture
    GERMAN JOURNAL OF AGRICULTURAL ECONOMICS 63, 156 (2014)
  • Stoeger Bernhard, Hieckel Marcel, Mittendorfer Florian, Wang Zhiming, Schmid Michael, Parkinson Gareth S., Fobes David, Peng Jin, Ortmann John E., Limbeck Andreas, Mao Zhiqiang, Redinger Josef, Diebold Ulrike
    Point defects at cleaved Srn+1 RunO3n+1(001) surfaces
    PHYSICAL REVIEW B 90, 165438 (2014)
  • Linder Tobias, Saxena Priyanka, Timin Eugen, Hering Steffen, Stary-Weinzinger Anna
    Structural Insights into Trapping and Dissociation of Small Molecules in K+ Channels
    JOURNAL OF CHEMICAL INFORMATION AND MODELING 54, 3218 (2014)
  • Narros Arturo, Likos Christos N., Moreno Angel J., Capone Barbara
    Multi-blob coarse graining for ring polymer solutions
    SOFT MATTER 10, 9601 (2014)
  • Zhou Liangcai, Koermann Fritz, Holec David, Bartosik Matthias, Grabowski Blazej, Neugebauer Joerg, Mayrhofer Paul H.
    Structural stability and thermodynamics of CrN magnetic phases from ab initio calculations and experiment
    PHYSICAL REVIEW B 90, 184102 (2014)
  • Borbely S., Feist J., Tokesi K., Nagele S., Nagy L., Burgdoerfer J.
    Ionization of helium by slow antiproton impact: Total and differential cross sections
    PHYSICAL REVIEW A 90, 052706 (2014)
  • Heitzinger Clemens, Ringhofer Christian
    Hierarchies of transport equations for nanopores Equations derived from the Boltzmann equation and the modeling of confined structures
    JOURNAL OF COMPUTATIONAL ELECTRONICS 13, 801 (2014)
  • Richter Martin, Mai Sebastian, Marquetand Philipp, Gonzalez Leticia
    Ultrafast intersystem crossing dynamics in uracil unravelled by ab initio molecular dynamics
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS 16, 24423 (2014)
  • Leitold Christian, Dellago Christoph
    Folding mechanism of a polymer chain with short-range attractions
    JOURNAL OF CHEMICAL PHYSICS 141, 134901 (2014)
  • Klisch Anja, Atzberger Clement
    Evaluating Phenological Metrics derived from the MODIS Time Series over the European Continent
    PHOTOGRAMMETRIE FERNERKUNDUNG GEOINFORMATION None, 409 (2014)
  • Ivanov A. N., Hayano R. S., Hoellwieser R., Troitskaya N. I., Wellenzohn M., Berdnikov Ya. A.
    beta-decay rates of bare Ag-108(47+) and H-like Ag-108(46+) ions
    PHYSICAL REVIEW C 90, 034620 (2014)
  • Ules Thomas, Lueftner Daniel, Reinisch Eva Maria, Koller Georg, Puschnig Peter, Ramsey Michael G.
    Orbital tomography of hybridized and dispersing molecular overlayers
    PHYSICAL REVIEW B 90, 155430 (2014)
  • Kersten Michael, Tunega Daniel, Georgieva Ivelina, Vlasova Nataliya, Branscheid Robert
    Adsorption of the Herbicide 4-Chloro-2-methylphenoxyacetic Acid (MCPA) by Goethite
    ENVIRONMENTAL SCIENCE & TECHNOLOGY 48, 11803 (2014)
  • Scholtzova Eva, Madejova Jana, Tunega Daniel
    Structural properties of montmorillonite intercalated with tetraalkylammonium cations-Computational and experimental study
    VIBRATIONAL SPECTROSCOPY 74, 120 (2014)
  • Wiesenberger M., Madsen J., Kendl A.
    Radial convection of finite ion temperature, high amplitude plasma blobs
    PHYSICS OF PLASMAS 21, 092301 (2014)
  • Denk Christoph, Svatunek Dennis, Filip Thomas, Wanek Thomas, Lumpi Daniel, Froehlich Johannes, Kuntner Claudia, Mikula Hannes
    Development of a F-18-Labeled Tetrazine with Favorable Pharmacokinetics for Bioorthogonal PET Imaging
    ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 53, 9655 (2014)
  • Toson P., Wallisch W., Asali A., Fidler J.
    Modelling of Packed Co Nanorods for Hard Magnetic Applications
    JEMS 2013 - JOINT EUROPEAN MAGNETIC SYMPOSIA 75, 03002 (2014)
  • Abert Claas, Hrkac Gino, Page Marcus, Praetorius Dirk, Ruggeri Michele, Suess Dieter
    Spin-polarized transport in ferromagnetic multilayers: An unconditionally convergent FEM integrator
    COMPUTERS & MATHEMATICS WITH APPLICATIONS 68, 639 (2014)
  • Kuhlmann Hendrik C., Mukin Roman V., Sano Tomoaki, Ueno Ichiro
    Structure and dynamics of particle-accumulation in thermocapillary liquid bridges
    FLUID DYNAMICS RESEARCH 46, 041421 (2014)
  • Bruckner F., Suess D., Feischl M., Fuehrer T., Goldenits P., Page M., Praetorius D., Ruggeri M.
    Multiscale modeling in micromagnetics: Existence of solutions and numerical integration
    MATHEMATICAL MODELS & METHODS IN APPLIED SCIENCES 24, (2014)
  • Bedolla Pedro O., Feldbauer Gregor, Wolloch Michael, Gruber Christoph, Eder Stefan J., Doerr Nicole, Mohn Peter, Redinger Josef, Vernes Andras
    Density Functional Investigation of the Adsorption of Isooctane, Ethanol, and Acetic Acid on a Water-Covered Fe(100) Surface
    JOURNAL OF PHYSICAL CHEMISTRY C 118, 21428 (2014)

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