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.
 



806 entries found
with the tags:
  • Billes Ferenc, Pataki Hajnalka, Unsalan Ozan, Mikosch Hans, Vajna Balazs, Marosi Gyoergy
    Solvent effect on the vibrational spectra of Carvedilol
    SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY 95, 148 (2012)
  • Schmidt J., Schoenhart M., Biberacher M., Guggenberger T., Hausl S., Kalt G., Leduc S., Schardinger I., Schmid E.
    Regional energy autarky: Potentials, costs and consequences for an Austrian region
    ENERGY POLICY 47, 211 (2012)
  • Reith D., Stoehr M., Podloucky R., Kerscher T. C., Mueller S.
    First-principles modeling of temperature- and concentration-dependent solubility in the phase-separating alloy FexCu1-x
    PHYSICAL REVIEW B 86, 020201 (2012)
  • Marzi Daniela, Likos Christos N., Capone Barbara
    Coarse graining of star-polymer - colloid nanocomposites
    JOURNAL OF CHEMICAL PHYSICS 137, 014902 (2012)
  • Mittendorfer F., Weinert M., Podloucky R., Redinger J.
    Strain and Structure Driven Complex Magnetic Ordering of a CoO Overlayer on Ir(100)
    PHYSICAL REVIEW LETTERS 109, 015501 (2012)
  • Falmbigl M., Chen M. X., Grytsiv A., Rogl P., Royanian E., Michor H., Bauer E., Podloucky R., Giester G.
    Type-I clathrate Ba8NixSi46-x: Phase relations, crystal chemistry and thermoelectric properties
    DALTON TRANSACTIONS 41, 8839 (2012)
  • Lenz Dominic A., Blaak Ronald, Likos Christos N.
    Structural properties of dendrimer-colloid mixtures
    JOURNAL OF PHYSICS-CONDENSED MATTER 24, 284119 (2012)
  • Coluzza Ivan, Dellago Christoph
    The configurational space of colloidal patchy polymers with heterogeneous sequences
    JOURNAL OF PHYSICS-CONDENSED MATTER 24, 284111 (2012)
  • Sukrat Kanjarat, Tunega Daniel, Aquino Adelia J. A., Lischka Hans, Parasuk Vudhichai
    Proton exchange reactions of C2-C4 alkanes sorbed in ZSM-5 zeolite
    THEORETICAL CHEMISTRY ACCOUNTS 131, UNSP 1232 (2012)
  • Coluzza Ivan, MacDonald James T., Sadowski Michael I., Taylor William R., Goldstein Richard A.
    Analytic Markovian Rates for Generalized Protein Structure Evolution
    PLOS ONE 7, e34228 (2012)
  • Botana A. S., Tran F., Pardo V., Baldomir D., Blaha P.
    Electronic structure of CrN: A comparison between different exchange correlation potentials
    PHYSICAL REVIEW B 85, 235118 (2012)
  • Kungwan Nawee, Plasser Felix, Aquino Adelia J. A., Barbatti Mario, Wolschann Peter, Lischka Hans
    The effect of hydrogen bonding on the excited-state proton transfer in 2-(2 '-hydroxyphenyl) benzothiazole: a TDDFT molecular dynamics study
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS 14, 9016 (2012)
  • Igenbergs Katharina, Wallerberger Markus, Schweinzer Josef, Aumayr Friedrich
    Atomic-Orbital Close-Coupling Calculations for Collisions Involving Fusion Relevant Highly Charged Impurity Ions Using Very Large Basis Sets
    17TH INTERNATIONAL CONFERENCE ON ATOMIC PROCESSES IN PLASMAS (ICAPIP) 1438, 232 (2012)
  • Wissgott P., Kunes J., Toschi A., Held K.
    Dipole matrix element approach versus Peierls approximation for optical conductivity
    PHYSICAL REVIEW B 85, 205133 (2012)
  • Fiedler G., Fidler J., Lee J., Schrefl T., Stamps R. L., Braun H. B., Suess D.
    Direct calculation of the attempt frequency of magnetic structures using the finite element method
    JOURNAL OF APPLIED PHYSICS 111, 093917 (2012)
  • Yoshida S., Reinhold C. O., Burgdoerfer J., Wyker B., Ye S., Dunning F. B.
    Analysis of circular wave packets generated by pulsed electric fields
    NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS 279, 4 (2012)
  • Liertzer M., Ge Li, Cerjan A., Stone A. D., Tuereci H. E., Rotter S.
    Pump-Induced Exceptional Points in Lasers
    PHYSICAL REVIEW LETTERS 108, 173901 (2012)
  • Jacobson Peter, Stoeger Bernhard, Garhofer Andreas, Parkinson Gareth S., Schmid Michael, Caudillo Roman, Mittendorfer Florian, Redinger Josef, Diebold Ulrike
    Nickel Carbide as a Source of Grain Rotation in Epitaxial Graphene
    ACS NANO 6, 3564 (2012)
  • Yan X., Chen M. X., Laumann S., Bauer E., Rogl P., Podloucky R., Paschen S.
    Thermoelectric properties of Ba-Cu-Si clathrates
    PHYSICAL REVIEW B 85, 165127 (2012)
  • Zeiringer I., Chen MingXing, Grytsiv A., Bauer E., Podloucky R., Effenberger H., Rogl P.
    The ternary system Au-Ba-Si: Clathrate solution, electronic structure, physical properties, phase equilibria and crystal structures
    ACTA MATERIALIA 60, 2324 (2012)
  • Kupka Friedrich, Happenhofer Natalie, Higueras Inmaculada, Koch Othmar
    Total-variation-diminishing implicit-explicit Runge-Kutta methods for the simulation of double-diffusive convection in astrophysics
    JOURNAL OF COMPUTATIONAL PHYSICS 231, 3561 (2012)
  • Zonta Francesco, Marchioli Cristian, Soldati Alfredo
    Modulation of turbulence in forced convection by temperature-dependent viscosity
    JOURNAL OF FLUID MECHANICS 697, 150 (2012)
  • Hansmann P., Haverkort M. W., Toschi A., Sangiovanni G., Rodolakis F., Rueff J. P., Marsi M., Held K.
    Atomic and itinerant effects at the transition-metal x-ray absorption K pre-edge exemplified in the case of V2O3
    PHYSICAL REVIEW B 85, 115136 (2012)
  • Haegeman Jutho, Pirvu Bogdan, Weir David J., Cirac Ignacio, Osborne Tobias J., Verschelde Henri, Verstraete Frank
    Variational matrix product ansatz for dispersion relations
    PHYSICAL REVIEW B 85, 100408 (2012)
  • Das Hena, Sangiovanni G., Valli A., Held K., Saha-Dasgupta T.
    Comment on "Size Control of Charge-Orbital Order in Half-Doped Manganite La0.5Ca0.5MnO3" Reply
    PHYSICAL REVIEW LETTERS 108, 129702 (2012)
  • Camargo Manuel, Egorov Sergei A., Likos Christos N.
    Cluster formation in star-linear polymer mixtures: equilibrium and dynamical properties
    SOFT MATTER 8, 4177 (2012)
  • Nikoubashman Arash, Kahl Gerhard, Likos Christos N.
    Flow quantization and nonequilibrium nucleation of soft crystals
    SOFT MATTER 8, 4121 (2012)
  • Tunega Daniel
    Theoretical Study of Properties of Goethite (alpha-FeOOH) at Ambient and High-Pressure Conditions
    JOURNAL OF PHYSICAL CHEMISTRY C 116, 6703 (2012)
  • Punzet Manuel, Baurecht Dieter, Varga Franz, Karlic Heidrun, Heitzinger Clemens
    Determination of surface concentrations of individual molecule-layers used in nanoscale biosensors by in situ ATR-FTIR spectroscopy
    NANOSCALE 4, 2431 (2012)
  • Huissmann Sebastian, Likos Christos N., Blaak Ronald
    Explicit vs Implicit Water Simulations of Charged Dendrimers
    MACROMOLECULES 45, 2562 (2012)

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