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  1.  

    Excitation energies and Stokes shifts from a restricted open-shell Kohn-Sham approach

    Kowalczyk, Timothy Daniel / Tsuchimochi, Takashi / Chen, Po-Ta et al. | DSpace@MIT | 2013
  2.  

    Off-resonance NOVEL

    Jain, Sheetal K. / Mathies, Guinevere / Griffin, Robert G. | American Institute of Physics | 2017
  3.  

    Application of the mixed time-averaging semiclassical initial value representation method to complex molecular spectra

    Buchholz, Max / Grossmann, Frank / Ceotto, Michele | American Institute of Physics | 2017
  4.  

    Addition and removal energies of circular quantum dots

    Yuan, Fei / Novario, Samuel J. / Parzuchowski, Nathan M. et al. | American Institute of Physics | 2017
  5.  

    Configuration path integral Monte Carlo approach to the static density response of the warm dense electron gas

    Groth, Simon / Dornheim, Tobias / Bonitz, Michael | American Institute of Physics | 2017
  6.  

    Modelling realistic TiO2 nanospheres: A benchmark study of SCC-DFTB against hybrid DFT

    Selli, Daniele / Fazio, Gianluca / Di Valentin, Cristiana | American Institute of Physics | 2017
  7.  

    Fokker-Planck equation for the non-Markovian Brownian motion in the presence of a magnetic field

    Das, Joydip / Mondal, Shrabani / Bag, Bidhan Chandra | American Institute of Physics | 2017
  8.  

    Potential energy surfaces for O + O2 collisions

    Varga, Zoltan / Paukku, Yuliya / Truhlar, Donald G. | American Institute of Physics | 2017
  9.  

    Electronic energy transfer through non-adiabatic vibrational-electronic resonance. I. Theory for a dimer

    Tiwari, Vivek / Peters, William K. / Jonas, David M. | American Institute of Physics | 2017
  10.  

    Origin of diverse time scales in the protein hydration layer solvation dynamics: A simulation study

    Mondal, Sayantan / Mukherjee, Saumyak / Bagchi, Biman | American Institute of Physics | 2017
  11.  

    Preface: Special Topic on Reaction Pathways

    Clementi, Cecilia / Henkelman, Graeme | American Institute of Physics | 2017
  12.  

    Controlling the crystal polymorph by exploiting the time dependence of nucleation rates

    Little, Laurie J. / King, Alice A. K. / Sear, Richard P. et al. | American Institute of Physics | 2017
  13.  

    Isotopic effects in vibrational relaxation dynamics of H on a Si(100) surface

    Bouakline, F. / Lorenz, U. / Melani, G. et al. | American Institute of Physics | 2017
  14.  

    A study of accurate exchange-correlation functionals through adiabatic connection

    Singh, Rabeet / Harbola, Manoj K. | American Institute of Physics | 2017
  15.  

    First passage times for multiple particles with reversible target-binding kinetics

    Grebenkov, Denis S. | American Institute of Physics | 2017
  16.  

    Formation and decomposition of CO2-filled ice

    Massani, B. / Mitterdorfer, C. / Loerting, T. | American Institute of Physics | 2017
  17.  

    Decoupling of translational and rotational diffusion in quasi-2D colloidal fluids

    Vivek, Skanda / Weeks, Eric R. | American Institute of Physics | 2017

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