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The Journal of Chemical Physics|August 6, 2005
Hybrid approach for ab initio molecular dynamics simulation combining energy density analysis and short-time Fourier transform: energy transfer spectrogramYusuke Yamauchi, Hiromi NakaiThe Journal of Chemical Physics|August 6, 2005
Simulations of one- and two-electron systems by Bead-Fourier path integral molecular dynamicsSergei D Ivanov, Alexander P LyubartsevThe Journal of Chemical Physics|August 6, 2005
Atomic spin-orbit pseudopotential definition and its relation to the different relativistic approximationsEmmanuel Fromager, Christian Teichteil, Laurent MaronThe Journal of Chemical Physics|August 6, 2005
Theoretical and experimental studies of the infrared rovibrational spectrum of He2-N2OXiao-Gang Wang, Tucker Carrington, Jian Tang, et al.The Journal of Chemical Physics|August 6, 2005
Aminomethanol water elimination: theoretical examinationMichael T Feldmann, Susanna L Widicus, Geoffrey A Blake, et al.The Journal of Chemical Physics|August 6, 2005
Electronic structure and magnetic properties of small manganese oxide clustersMyung Joon Han, Taisuke Ozaki, Jaejun YuThe Journal of Chemical Physics|August 6, 2005
Photofragment angular momentum distribution beyond the axial recoil approximation: the role of molecular axis rotationVladislav V Kuznetsov, Oleg S VasyutinskiiThe Journal of Chemical Physics|August 6, 2005
Relaxation dynamics in (HF)x(H2O)1-x solutionsR Angelini, P Giura, G Monaco, et al.The Journal of Chemical Physics|August 6, 2005
Generalized Langevin theory on the dynamics of simple fluids under external fieldsT Yamaguchi, T Matsuoka, S KodaThe Journal of Chemical Physics|August 6, 2005
Ion association dynamics in aqueous solutions of sulfate salts as studied by Raman band shape analysisDaisuke Watanabe, Hiro-o HamaguchiPageof 5,307