Journal of Chemical Physics, 0021-9606

Tidskrift

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  1. 2015
  2. Ions confined in spherical dielectric cavities modeled by a splitting field-theory.

    Lue, L. & Linse, P., 2015, I : Journal of Chemical Physics. 142, 14, 144902.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  3. Longitudinal relaxation in dipole-coupled homonuclear three-spin systems: Distinct correlations and odd spectral densities.

    Chang, Z. & Bertil Halle, 2015, I : Journal of Chemical Physics. 143, 23, 234201.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  4. Model-free estimation of the effective correlation time for C-H bond reorientation in amphiphilic bilayers: (1)H-(13)C solid-state NMR and MD simulations.

    Ferreira, T., Ollila, S., Pigliapochi, R., Dabkowska, A. & Daniel Topgaard, 2015, I : Journal of Chemical Physics. 142, 4, 044905.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  5. Photoinduced reduction of surface states in Fe:ZnO.

    Knut, R., Lagerqvist, U., Palmgren, P., Pal, P., Svedlindh, P., Pohl, A. & Karis, O., 2015, I : Journal of Chemical Physics. 142, 20, 204703.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  6. Spectroscopic identification of ethanol-water conformers by large-amplitude hydrogen bond librational modes.

    Andersen, J., Heimdal, J. & Wugt Larsen, R., 2015, I : Journal of Chemical Physics. 143, 22, 224315.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  7. Thermodynamics of amyloid formation and the role of intersheet interactions

    Anders Irbäck & Wessén, J., 2015, I : Journal of Chemical Physics. 143, 10, 105104.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  8. X-ray emission spectroscopy of bulk liquid water in "no-man's land".

    Sellberg, J. A., McQueen, T. A., Laksmono, H., Schreck, S., Beye, M., DePonte, D. P., Kennedy, B., Nordlund, D., Sierra, R. G., Schlesinger, D., Tokushima, T., Zhovtobriukh, I., Eckert, S., Segtnan, V. H., Ogasawara, H., Kubicek, K., Techert, S., Bergmann, U., Dakovski, G. L., Schlotter, W. F. & 6 andraHarada, Y., Bogan, M. J., Wernet, P., Föhlisch, A., Pettersson, L. G. M. & Nilsson, A., 2015, I : Journal of Chemical Physics. 142, 4, 044505.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  9. 2014
  10. Alloying and oxidation of in situ produced core-shell Al@Yb nanoalloy particles-An "on-the-fly" study.

    Zhang, C., Andersson, T., Mikko-Heikki Mikkelä, Mårsell, E., Björneholm, O., Xu, X., Maxim Tchaplyguine & Liu, Z., 2014, I : Journal of Chemical Physics. 141, 8, 084302.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  11. Breakdown of ionic character of molecular alkali bromides in inner-valence photoionization

    Karpenko, A., Iablonskyi, D., Urpelainen, S., Kettunen, J. A., Cao, W., Huttula, M. & Aksela, H., 2014, I : Journal of Chemical Physics. 140, 20, 204321.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  12. Carbon dioxide ion dissociations after inner shell excitation and ionization: The origin of site-specific effects.

    Eland, J. H. D., Zagorodskikh, S., Squibb, R. J., Mucke, M., Stacey Ristinmaa Sörensen & Feifel, R., 2014, I : Journal of Chemical Physics. 140, 18, 184305.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  13. Combined treatment of relaxation and fluctuation dynamics in the calculation of two-dimensional electronic spectra.

    Seibt, J. & Tönu Pullerits, 2014, I : Journal of Chemical Physics. 141, 11, 114106.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  14. Communication: THz absorption spectrum of the CO2-H2O complex: Observation and assignment of intermolecular van der Waals vibrations.

    Andersen, J., Heimdal, J., Mahler, D. W., Nelander, B. & Wugt Larsen, R., 2014, I : Journal of Chemical Physics. 140, 9, 091103.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  15. Dielectric response from lattices of dipoles with fixed orientation.

    Thuresson, A. & Gunnar Karlström, 2014, I : Journal of Chemical Physics. 141, 23, 234505.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  16. Effective interactions between soft-repulsive colloids: Experiments, theory, and simulations.

    Mohanty, P., Paloli, D., Jerome Crassous, Zaccarelli, E. & Peter Schurtenberger, 2014, I : Journal of Chemical Physics. 140, 9, 094901.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  17. Effects of non-local exchange on core level shifts for gas-phase and adsorbed molecules.

    Van den Bossche, M., Martin, N., Johan Gustafson, Hakanoglu, C., Weaver, J. F., Edvin Lundgren & Grönbeck, H., 2014, I : Journal of Chemical Physics. 141, 3, 034706.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  18. Equation of state for Eu-doped SrSi2O2N2

    Ermakova, O., Paszkowicz, W., Kaminska, A., Barzowska, J., Szczodrowski, K., Grinberg, M., Minikayev, R., Nowakowska, M., Stefan Carlson, Li, G., Liu, R-S. & Suchocki, A., 2014, I : Journal of Chemical Physics. 141, 1, 014705.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  19. Exact evaluation of the depletion force between nanospheres in a polydisperse polymer fluid under Θ conditions.

    Wang, H., Woodward, C. E. & Jan Forsman, 2014, I : Journal of Chemical Physics. 140, 19, 194903.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  20. Green's function for a spherical dielectric discontinuity and its application to simulation

    Linse, P. & Lue, L., 2014, I : Journal of Chemical Physics. 140, 4, 044903.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  21. Hybrid Monte Carlo with non-uniform step size

    Holzgräfe, C., Bhattacherjee, A. & Anders Irbäck, 2014, I : Journal of Chemical Physics. 140, 4, 044105.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  22. Non-Markovian effects in the first-passage dynamics of obstructed tracer particle diffusion in one-dimensional systems.

    Forsling, R., Sanders, L., Tobias Ambjörnsson & Lizana, L., 2014, I : Journal of Chemical Physics. 141, 9, 094902.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  23. Suppression of the molecular ultra-fast dissociation in bromomethane clusters.

    Rander, T., Lindblad, A., Bradeanu, I., Gunnar Öhrwall, Svensson, S. & Björneholm, O., 2014, I : Journal of Chemical Physics. 141, 22, 224305.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  24. The effect of hydrogen bonding on torsional dynamics: A combined far-infrared jet and matrix isolation study of methanol dimer.

    Kollipost, F., Andersen, J., Mahler, D. W., Heimdal, J., Heger, M., Suhm, M. A. & Wugt Larsen, R., 2014, I : Journal of Chemical Physics. 141, 17, 174314.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  25. Topological effects on capsomer-polyion co-assembly

    Zhang, R. & Linse, P., 2014, I : Journal of Chemical Physics. 140, 24, 244903.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  26. Tuning the smooth particle mesh Ewald sum: Application on ionic solutions and dipolar fluids

    Linse, B. & Linse, P., 2014, I : Journal of Chemical Physics. 141, 18, 184114.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  27. Unraveling the nature of coherent beatings in chlorosomes.

    Dostal, J., Mančal, T., Vácha, F., Pšenčík, J. & Donatas Zigmantas, 2014, I : Journal of Chemical Physics. 140, 11, 115103.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  28. 2013
  29. Ion-pairing in aqueous CaCl2 and RbBr solutions: Simultaneous structural refinement of XAFS and XRD data

    Pham, V-T. & Fulton, J. L., 2013 jan 28, I : Journal of Chemical Physics. 138, 4, 044201.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  30. Colloidal gelation with variable attraction energy

    Zaccone, A., Jerome Crassous & Ballauff, M., 2013, I : Journal of Chemical Physics. 138, 10, 104908.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  31. Core-shell structure disclosed in self-assembled Cu-Ag nanoalloy particles.

    Maxim Tchaplyguine, Andersson, T., Zhang, C. & Björneholm, O., 2013, I : Journal of Chemical Physics. 138, 10, 104303.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  32. Grain boundary melting in ice

    Thomson, E. S., Hansen-Goos, H., Wettlaufer, J. S. & Wilen, L. A., 2013, I : Journal of Chemical Physics. 138, 12, s. 124707-124707

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  33. Icosahedral capsid formation by capsomers and short polyions.

    Zhang, R. & Linse, P., 2013, I : Journal of Chemical Physics. 138, 15, 154901.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  34. Perspective: Coulomb fluids-Weak coupling, strong coupling, in between and beyond

    Naji, A., Kanduc, M., Jan Forsman & Podgornik, R., 2013, I : Journal of Chemical Physics. 139, 15

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  35. Solvation at nanoscale: Alkali-halides in water clusters

    Partanen, L., Mikkela, M-H., Huttula, M., Maxim Tchaplyguine, Zhang, C., Andersson, T. & Bjorneholm, O., 2013, I : Journal of Chemical Physics. 138, 4, 044301.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  36. The coupling between translation and rotation for monomeric water in noble gas matrices.

    Ceponkus, J., Per Uvdal & Nelander, B., 2013, I : Journal of Chemical Physics. 138, 24, 244305.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  37. The photoelectron angular distribution of water clusters

    Zhang, C., Andersson, T., Foerstel, M., Mucke, M., Arion, T., Maxim Tchaplyguine, Bjorneholm, O. & Hergenhahn, U., 2013, I : Journal of Chemical Physics. 138, 23, 234306.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  38. 2012
  39. Attraction between neutral dielectrics mediated by multivalent ions in an asymmetric ionic fluid

    Kanduc, M., Naji, A., Jan Forsman & Podgornik, R., 2012, I : Journal of Chemical Physics. 137, 17, 174704.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  40. Density functional theory for Yukawa fluids

    Hatlo, M. M., Banerjee, P., Jan Forsman & Lue, L., 2012, I : Journal of Chemical Physics. 137, 6, 064115.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  41. Direct measurement of S-branch N(2)-H(2) Raman linewidths using time-resolved pure rotational coherent anti-Stokes Raman spectroscopy.

    Bohlin, A., Nordström, E., Patterson, B. D., Per-Erik Bengtsson & Kliewer, C. J., 2012, I : Journal of Chemical Physics. 137, 7, 074302.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  42. First passage times for a tracer particle in single file diffusion and fractional Brownian motion.

    Sanders, L. & Tobias Ambjörnsson, 2012, I : Journal of Chemical Physics. 136, 17, 175103.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  43. Free volume dilatation in polymers by ortho-positronium.

    Winberg, P., Eldrup, M. & Maurer, F., 2012, I : Journal of Chemical Physics. 136, 24, 244902.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  44. Influence of structure in heterodyne electrophoretic light scattering.

    Medebach, M., 2012, I : Journal of Chemical Physics. 136, 4, 044201.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  45. Inhomogeneous charge transfer within monolayer zinc phthalocyanine absorbed on TiO2(110)

    Yu, S., Ahmadi, S., Sun, C., Adibi, P. T. Z., Chow, W., Pietzsch, A. & Gothelid, M., 2012, I : Journal of Chemical Physics. 136, 15

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  46. Many-body interactions between particles in a polydisperse polymer fluid

    Woodward, C. E. & Jan Forsman, 2012, I : Journal of Chemical Physics. 136, 8

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  47. Photoinduced electron transfer processes in dye-semiconductor systems with different spacer groups

    Li, J., Wang, H., Petter Persson & Thoss, M., 2012, I : Journal of Chemical Physics. 137, 22, 22A529.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  48. Potassium-intercalated H2Pc films: Alkali-induced electronic and geometrical modifications

    Nilson, K., Ahlund, J., Shariati, M. -N., Schiessling, J., Palmgren, P., Brena, B., Gothelid, E., Franz Hennies, Huismans, Y., Evangelista, F., Rudolf, P., Gothelid, M., Mårtensson, N. & Puglia, C., 2012, I : Journal of Chemical Physics. 137, 4

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  49. Role of the Renner-Teller effect after core hole excitation in the dissociation dynamics of carbon dioxide dication.

    Laksman, J., Månsson, E., Grunewald, C., Sankari, A., Mathieu Gisselbrecht, Céolin, D. & Stacey Ristinmaa Sörensen, 2012, I : Journal of Chemical Physics. 136, 10, 104303.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  50. Rotational dynamics in supercooled water from nuclear spin relaxation and molecular simulations.

    Qvist, J., Mattea, C., Persson Sunde, E. & Bertil Halle, 2012, I : Journal of Chemical Physics. 136, 20, 204505.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  51. Size selective spectroscopy of Se microclusters

    Kooser, K., Ha, D. T., Itala, E., Laksman, J., Urpelainen, S. & Kukk, E., 2012, I : Journal of Chemical Physics. 137, 4

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift