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.
 



779 entries found
with the tags:
  • 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)
  • Plasser Felix, Aquino Adelia J. A., Hase William L., Lischka Hans
    UV Absorption Spectrum of Alternating DNA Duplexes. Analysis of Excitonic and Charge Transfer Interactions
    JOURNAL OF PHYSICAL CHEMISTRY A 116, 11151 (2012)
  • Kerscher Tobias C., Landgraf Wolfgang, Podloucky Raimund, Mueller Stefan
    Adsorbate-induced segregation: First-principles study for C/Pt25Rh75(100)
    PHYSICAL REVIEW B 86, 195420 (2012)
  • Jantimapornkij Patcharawee, Jundee Piebprom, Uttamapinant Nattakarn, Pianwanit Somsak, Karpfen Alfred
    A-H center dot center dot center dot pi hydrogen bonding to acetylene and benzene: The role of intramolecular coupling
    COMPUTATIONAL AND THEORETICAL CHEMISTRY 999, 231 (2012)
  • Ploeckinger S., Hensler G.
    Do high-velocity clouds trace the dark matter subhalo population?
    ASTRONOMY & ASTROPHYSICS 547, A43 (2012)
  • Richter Martin, Marquetand Philipp, Gonzalez-Vazquez Jesus, Sola Ignacio, Gonzalez Leticia
    Femtosecond Intersystem Crossing in the DNA Nucleobase Cytosine
    JOURNAL OF PHYSICAL CHEMISTRY LETTERS 3, 3090 (2012)
  • Parragh Nicolaus, Toschi Alessandro, Held Karsten, Sangiovanni Giorgio
    Conserved quantities of SU(2)-invariant interactions for correlated fermions and the advantages for quantum Monte Carlo simulations
    PHYSICAL REVIEW B 86, 155158 (2012)
  • Hlevnjak Mario, Polyansky Anton A., Zagrovic Bojan
    Sequence signatures of direct complementarity between mRNAs and cognate proteins on multiple levels
    NUCLEIC ACIDS RESEARCH 40, 8874 (2012)

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