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.
 



936 entries found
with the tags:
  • Zhou Liangcai, Holec David, Mayrhofer Paul H.
    First-principles study of elastic properties of cubic Cr1-xAlxN alloys
    JOURNAL OF APPLIED PHYSICS 113, 043511 (2013)
  • Nikoubashman Arash, Likos Christos N., Kahl Gerhard
    Computer simulations of colloidal particles under flow in microfluidic channels
    SOFT MATTER 9, 2603 (2013)
  • Uzunova Ellie L., Mikosch Hans, St Nikolov Georgi
    Density functional study of copper-exchanged zeolites and related microporous materials: Adsorption of nitrosyls
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 113, 723 (2013)
  • Jungblut Swetlana, Dellago Christoph
    Crystallization on prestructured seeds
    PHYSICAL REVIEW E 87, 012305 (2013)
  • Xu Yuanhui, Hao Xianfeng, Franchini Cesare, Gao Faming
    Structural, Electronic, and Ferroelectric Properties of Compressed CdPbO3 Polymorphs
    INORGANIC CHEMISTRY 52, 1032 (2013)
  • Falmbig M., Kneidinger F., Chen M., Grytsiv A., Michor H., Royanian E., Bauer E., Effenberger H., Podloucky R., Rogl P.
    Cage-Forming Compounds in the Ba-Rh-Ge System: From Thermoelectrics to Superconductivity
    INORGANIC CHEMISTRY 52, 931 (2013)
  • Pacile Daniela, Leicht Philipp, Papagno Marco, Sheverdyaeva Polina M., Moras Paolo, Carbone Carlo, Krausert Konstantin, Zielke Lukas, Fonin Mikhail, Dedkov Yuriy S., Mittendorfer Florian, Doppler Joerg, Garhofer Andreas, Redinger Josef
    Artificially lattice-mismatched graphene/metal interface: Graphene/Ni/Ir(111)
    PHYSICAL REVIEW B 87, 035420 (2013)
  • Punkvang Auradee, Pungpo Pornpan, Kamsri Pharit, Kasamsri Dararat, Srisupan Apinya, Saparpakorn Patchreenart, Hannongbua Supa, Wolschann Peter, Prueksaaroon Supakit, Pongprom Nipawan
    Molecular Dynamics simulations of azanaphthoquinone annelated pyrrole derivatives as anticancer agent in DNA duplex
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 113, 555 (2013)
  • Voloshina E. N., Fertitta E., Garhofer A., Mittendorfer F., Fonin M., Thissen A., Dedkov Yu. S.
    Electronic structure and imaging contrast of graphene moire on metals
    SCIENTIFIC REPORTS 3, 1072 (2013)
  • Attems Maximilian, Rebhan Anton, Strickland Michael
    Instabilities of an anisotropically expanding non-Abelian plasma: 3D+3V discretized hard-loop simulations
    PHYSICAL REVIEW D 87, 025010 (2013)
  • Bernabei Marco, Bacova Petra, Moreno Angel J., Narros Arturo, Likos Christos N.
    Fluids of semiflexible ring polymers: effective potentials and clustering
    SOFT MATTER 9, 1287 (2013)
  • Coluzza Ivan, van Oostrum Peter D. J., Capone Barbara, Reimhult Erik, Dellago Christoph
    Design and folding of colloidal patchy polymers
    SOFT MATTER 9, 938 (2013)
  • Abert Claas, Exl Lukas, Selke Gunnar, Drews Andre, Schrefl Thomas
    Numerical methods for the stray-field calculation: A comparison of recently developed algorithms
    JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS 326, 176 (2013)
  • Schoellhammer Gunther, Karsai Ferenc, Herzig Peter
    Fluorite-Type Rare-Earth Hydrides Studied from First Principles In ``Properties of Fluorite Structure Materials'', Editors:
    Nova Science Publishers (N.Y., USA)
  • Zhicheng Zhong, Wissgott Philipp, Held Karsten, Sangiovanni Giorgio
    Microscopic understanding of the orbital splitting and its tuning at oxide interfaces
    Europhysics Letters 99, (2012)
  • Xinhua Xie, Roither Stefan, Kartashov Daniil, Persson Emil, Arbo Diego G., Li Zhang, Grafe Stefanie, Schoffler Markus S., Burgdorfer Joachim, Baltuska Andrius, Kitzler Markus
    Attosecond Probe of Valence-Electron Wave Packets by Subcycle Sculpted Laser Fields
    Physical Review Letters 108, (2012)
  • Kubicki James D., Tunega Daniel, Kraemer Stephan
    Oxalate adsorption onto the (010) surface of goethite
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 244, (2012)
  • Linder Tobias, Stary-Weinzinger Anna
    Pore Gating of K plus Channels Studied by Essential Dynamics Simulations using the Simplified Bacterial K plus Channel KcsA
    BIOPHYSICAL JOURNAL 102, 397A (2012)
  • Igenbergs Katharina, Wallerberger Markus, Schweinzer Josef, Aumayr Friedrich
    Atomic-orbital close-coupling calculations of charge exchange and ionisation in collisions of H(1s) and highly charged neon and argon ions
    XXVII INTERNATIONAL CONFERENCE ON PHOTONIC, ELECTRONIC AND ATOMIC COLLISIONS (ICPEAC 2011), PTS 1-15 388, 082056 (2012)
  • Wallerberger Markus, Igenbergs Katharina, Schweinzer Josef, Aumayr Friedrich
    Fast computation of large-scale close-coupling systems on the example of N7+ - H collisions
    XXVII INTERNATIONAL CONFERENCE ON PHOTONIC, ELECTRONIC AND ATOMIC COLLISIONS (ICPEAC 2011), PTS 1-15 388, 082055 (2012)
  • Neubauer David, Vrtala Aron, Leitner Johannes J., Firneis Maria Gertrude, Hitzenberger Regina
    The life supporting zone of Kepler-22b and the Kepler planetary candidates: KOI268.01, KOI701.03, KOI854.01 and KOI1026.01
    PLANETARY AND SPACE SCIENCE 73, 397 (2012)
  • DeSouza Alexander L., Vorobyov Eduard I., Basu Shantanu
    The Burst Mode of Accretion in Primordial Star Formation
    FIRST STARS IV - FROM HAYASHI TO THE FUTURE 1480, 346 (2012)
  • Plasser Felix, Granucci Giovanni, Pittner Jiri, Barbatti Mario, Persico Maurizio, Lischka Hans
    Surface hopping dynamics using a locally diabatic formalism: Charge transfer in the ethylene dimer cation and excited state dynamics in the 2-pyridone dimer
    JOURNAL OF CHEMICAL PHYSICS 137, 22A514 (2012)
  • Libisch F., Rotter S., Burgdoerfer J.
    Coherent transport through graphene nanoribbons in the presence of edge disorder
    NEW JOURNAL OF PHYSICS 14, 123006 (2012)
  • Troeppner C., Schmitt T., Reuschl M., Hammer L., Schneider M. A., Mittendorfer F., Redinger J., Podloucky R., Weinert M.
    Incommensurate Moire overlayer with strong local binding: CoO(111) bilayer on Ir(100)
    PHYSICAL REVIEW B 86, 235407 (2012)
  • Capone Barbara, Coluzza Ivan, LoVerso Federica, Likos Christos N., Blaak Ronald
    Telechelic Star Polymers as Self-Assembling Units from the Molecular to the Macroscopic Scale
    PHYSICAL REVIEW LETTERS 109, 238301 (2012)
  • Lenz Dominic A., Blaak Ronald, Likos Christos N., Mladek Bianca M.
    Microscopically Resolved Simulations Prove the Existence of Soft Cluster Crystals
    PHYSICAL REVIEW LETTERS 109, 228301 (2012)
  • Dietz O., Stoeckmann H. -J., Kuhl U., Izrailev F. M., Makarov N. M., Doppler J., Libisch F., Rotter S.
    Surface scattering and band gaps in rough waveguides and nanowires
    PHYSICAL REVIEW B 86, 201106 (2012)
  • Matthews Richard, Louis Ard A., Likos Christos N.
    Effect of Bending Rigidity on the Knotting of a Polymer under Tension
    ACS MACRO LETTERS 1, 1352 (2012)
  • Boonyarattanakalin Kanokthip, Wolschann Peter, Toochinda Pisanu, Lawtrakul Luckhana
    Molecular dynamics simulations of UC781-cyclodextrins inclusion complexes in aqueous solution
    EUROPEAN JOURNAL OF PHARMACEUTICAL SCIENCES 47, 752 (2012)

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