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.
 



1214 entries found
with the tags:
  • Erbahar Dogan, Susi Toma, Rocquefelte Xavier, Bittencourt Carla, Scardamaglia Mattia, Blaha Peter, Guttmann Peter, Rotas Georgios, Tagmatarchis Nikos, Zhu Xiaohui, Hitchcock Adam P., Ewels Chris P.
    Spectromicroscopy of C-60 and azafullerene C59N: Identifying surface adsorbed water
    SCIENTIFIC REPORTS 6, 35605 (2016)
  • Susi Toma, Hofer Christoph, Argentero Giacomo, Leuthner Gregor T., Pennycook Timothy J., Mangler Clemens, Meyer Jannik C., Kotakoski Jani
    Isotope analysis in the transmission electron microscope
    NATURE COMMUNICATIONS 7, 13040 (2016)
  • Kasture Ameya, El-Kasaby Ali, Szollosi Daniel, Asjad H. M. Mazhar, Grimm Alexandra, Stockner Thomas, Hummel Thomas, Freissmuth Michael, Sucic Sonja
    Functional Rescue of a Misfolded Drosophila melanogaster Dopamine Transporter Mutant Associated with a Sleepless Phenotype by Pharmacological Chaperones
    JOURNAL OF BIOLOGICAL CHEMISTRY 291, 20876 (2016)
  • Wang Yin, Gkeka Paraskevi, Fuchs Julian E., Liedl Klaus R., Cournia Zoe
    DPPC-cholesterol phase diagram using coarse-grained Molecular Dynamics simulations
    BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES 1858, 2846 (2016)
  • Jungblut S., Dellago C.
    Pathways to self-organization: Crystallization via nucleation and growth
    SOFT MATTER SELF-ASSEMBLY 193, 217 (2016)
  • Gunacker P., Wallerberger M., Ribic T., Hausoel A., Sangiovanni G., Held K.
    Worm-improved estimators in continuous-time quantum Monte Carlo
    PHYSICAL REVIEW B 94, 125153 (2016)
  • Mueller Danny, Knoll Christian, Seifried Marco, Weinberger Peter
    ATR or transmission-A variable temperature study comparing both techniques using [Fe(3ditz)(3)](BF4)(2) as model system
    VIBRATIONAL SPECTROSCOPY 86, 198 (2016)
  • Borges Itamar Jr., Uhl Elmar, Modesto-Costa Lucas, Aquino Adelia J. A., Lischka Hans
    Insight into the Excited State Electronic and Structural Properties of the Organic Photovoltaic Donor Polymer Poly(thieno[3,4-b]thiophene benzodithiophene) by Means of ab Initio and Density Functional Theory
    JOURNAL OF PHYSICAL CHEMISTRY C 120, 21818 (2016)
  • Ivanov A. N., Cronenberg G., Hoellwieser R., Jenke T., Pitschmann M., Wellenzohn M., Abele H.
    Exact solution for chameleon field, self-coupled through the Ratra-Peebles potential with n=1 and confined between two parallel plates
    PHYSICAL REVIEW D 94, 085005 (2016)
  • Rupp Karl, Weinbub Josef, Juengel Ansgar, Grasser Tibor
    Pipelined Iterative Solvers with Kernel Fusion for Graphics Processing Units
    ACM TRANSACTIONS ON MATHEMATICAL SOFTWARE 43, 11 (2016)
  • Kernbichler W., Kasilov S. V., Kapper G., Martitsch A. F., Nemov V. V., Albert C., Heyn M. F.
    Solution of drift kinetic equation in stellarators and tokamaks with broken symmetry using the code NEO-2
    PLASMA PHYSICS AND CONTROLLED FUSION 58, 104001 (2016)
  • Prikopa Karl E., Gansterer Wilfried N., Wimmer Elias
    Parallel iterative refinement linear least squares solvers based on all-reduce operations
    PARALLEL COMPUTING 57, 167 (2016)
  • McCann Jamie, Schneeweiss Gerald M., Stuessy Tod F., Villasenor Jose L., Weiss-Schneeweiss Hanna
    The Impact of Reconstruction Methods, Phylogenetic Uncertainty and Branch Lengths on Inference of Chromosome Number Evolution in American Daisies (Melampodium, Asteraceae)
    PLOS ONE 11, e0162299 (2016)
  • Larimian Seyedreza, Erattupuzha Sonia, Lemell Christoph, Yoshida Shuhei, Nagele Stefan, Maurer Raffael, Baltuska Andrius, Burgdoerfer Joachim, Kitzler Markus, Xie Xinhua
    Coincidence spectroscopy of high-lying Rydberg states produced in strong laser fields
    PHYSICAL REVIEW A 94, 033401 (2016)
  • Jungblut Swetlana, Dellago Christoph
    Heterogeneous Crystallization on Pairs of Pre-Structured Seeds
    JOURNAL OF PHYSICAL CHEMISTRY B 120, 9230 (2016)
  • Tona Veronica, Ruider Stefan A., Berger Martin, Shaaban Saad, Padmanaban Mohan, Xie Lan-Gui, Gonzalez Leticia, Maulide Nuno
    Divergent ynamide reactivity in the presence of azides - an experimental and computational study
    CHEMICAL SCIENCE 7, 6032 (2016)
  • Muldoon Frank H., Kuhlmann Hendrik C.
    Origin of particle accumulation structures in liquid bridges: Particle-boundary-interactions versus inertia
    PHYSICS OF FLUIDS 28, 073305 (2016)
  • Doppler Jorg, Mailybaev Alexei A., Bohm Julian, Kuhl Ulrich, Girschik Adrian, Libisch Florian, Milburn Thomas J., Rabl Peter, Moiseyev Nimrod, Rotter Stefan
    Dynamically encircling an exceptional point for asymmetric mode switching
    NATURE 537, 76 (2016)
  • Scheiber Daniel, Pippan Reinhard, Puschnig Peter, Ruban Andrei, Romaner Lorenz
    Ab-initio search for cohesion-enhancing solute elements at grain boundaries in molybdenum and tungsten
    INTERNATIONAL JOURNAL OF REFRACTORY METALS & HARD MATERIALS 60, 75 (2016)
  • Leitold Christian, Dellago Christoph
    Nucleation and structural growth of cluster crystals
    JOURNAL OF CHEMICAL PHYSICS 145, 074504 (2016)
  • Silva Nadeesha J., Machado Francisco B. C., Lischka Hans, Aquino Adelia J. A.
    pi-pi stacking between polyaromatic hydrocarbon sheets beyond dispersion interactions
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS 18, 22300 (2016)
  • Sato Takeshi, Ishikawa Kenichi L., Brezinova Iva, Lackner Fabian, Nagele Stefan, Burgdoerfer Joachim
    Time-dependent complete-active-space self-consistent-field method for atoms: Application to high-order harmonic generation
    PHYSICAL REVIEW A 94, 023405 (2016)
  • Bliem Roland, van der Hoeven Jessi E. S., Hulva Jan, Pavelec Jiri, Gamba Oscar, de Jongh Petra E., Schmid Michael, Blaha Peter, Diebold Ulrike, Parkinson Gareth S.
    Dual role of CO in the stability of subnano Pt clusters at the Fe3O4(001) surface
    PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA 113, 8921 (2016)
  • Vazdar Mario, Eckert-Maksic Mirjana, Lischka Hans
    The Antiferromagnetic Spin Coupling in Non-Kekule Acenes-Impressive Polyradical Character Revealed by High-Level Multireference Methods
    CHEMPHYSCHEM 17, 2013 (2016)
  • Plasser Felix, Gonzalez Leticia
    Communication: Unambiguous comparison of many-electron wavefunctions through their overlaps
    JOURNAL OF CHEMICAL PHYSICS 145, 021103 (2016)
  • Reilly Anthony M., Cooper Richard I., Adjiman Claire S., Bhattacharya Saswata, Boese A. Daniel, Brandenburg Jan Gerit, Bygrave Peter J., Bylsma Rita, Campbell Josh E., Car Roberto, Case David H., Chadha Renu, Cole Jason C., Cosburn Katherine, Cuppen Herma
    Report on the sixth blind test of organic crystal structure prediction methods
    ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS 72, 439 (2016)
  • Schampera B., Tunega D., Solc R., Woche S. K., Mikutta R., Wirth R., Dultz S., Guggenberger G.
    External surface structure of organoclays analyzed by transmission electron microscopy and X-ray photoelectron spectroscopy in combination with molecular dynamics simulations
    JOURNAL OF COLLOID AND INTERFACE SCIENCE 478, 188 (2016)
  • Morawietz Tobias, Singraber Andreas, Dellago Christoph, Behler Joerg
    How van der Waals interactions determine the unique properties of water
    PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA 113, 8368 (2016)
  • Ferstl Pascal, Hammer Lutz, Sobel Christopher, Gubo Matthias, Heinz Klaus, Schneider M. Alexander, Mittendorfer Florian, Redinger Josef
    Self-Organized Growth, Structure, and Magnetism of Monatomic Transition-Metal Oxide Chains
    PHYSICAL REVIEW LETTERS 117, 046101 (2016)
  • Greensite Jeff, Hoellwieser Roman
    Relative weights approach to SU(3) gauge theories with dynamical fermions at finite density
    PHYSICAL REVIEW D 94, 014504 (2016)

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