Journal of Chemical Physics, 0021-9606

Tidskrift

Fler filtreringsmöjligheter
  1. 2011
  2. Dissimilar bouncy walkers

    Lomholt, M. A., Lizana, L. & Tobias Ambjörnsson, 2011, I : Journal of Chemical Physics. 134, 4, 045101.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  3. Ionic bonding in free nanoscale NaCl clusters as seen by photoelectron spectroscopy

    Zhang, C., Andersson, T., Svensson, S., Bjorneholm, O., Huttula, M., Mikkela, M-H., Maxim Tchaplyguine & Gunnar Öhrwall, 2011, I : Journal of Chemical Physics. 134, 12, 124507.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  4. Macroion solutions in the cell model studied by field theory and Monte Carlo simulations.

    Lue, L. & Linse, P., 2011, I : Journal of Chemical Physics. 135, 22, 224508.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  5. Mutation-induced fold switching among lattice proteins.

    Holzgräfe, C., Anders Irbäck & Carl Troein, 2011, I : Journal of Chemical Physics. 135, 19, 195101.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  6. On the structure of the matrix isolated water trimer.

    Ceponkus, J., Per Uvdal & Nelander, B., 2011, I : Journal of Chemical Physics. 134, 6, 064309.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  7. Plasmon single- and multi-quantum excitation in free metal clusters as seen by photoelectron spectroscopy.

    Andersson, T., Zhang, C., Aldana Rosso, Bradeanu, I., Legendre, S., Canton, S., Maxim Tchaplyguine, Gunnar Öhrwall, Stacey Ristinmaa Sörensen, Svensson, S., Mårtensson, N. & Björneholm, O., 2011, I : Journal of Chemical Physics. 134, 9, 094511.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  8. Structural dynamics of supercooled water from quasielastic neutron scattering and molecular simulations.

    Qvist, J., Schober, H. & Bertil Halle, 2011, I : Journal of Chemical Physics. 134, 14, 144508.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  9. 2010
  10. Acceptor switching and axial rotation of the water dimer in matrices, observed by infrared spectroscopy.

    Ceponkus, J., Per Uvdal & Nelander, B., 2010, I : Journal of Chemical Physics. 133, 7, 074301.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  11. Adsorption geometry, molecular interaction, and charge transfer of triphenylamine-based dye on rutile TiO2(110)

    Yu, S., Ahmadi, S., Zuleta, M., Tian, H., Karina Schulte, Pietzsch, A., Franz Hennies, Weissenrieder, J., Yang, X. & Gothelid, M., 2010, I : Journal of Chemical Physics. 133, 22, 224704.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  12. Basis set representation of the electron density at an atomic nucleus

    Mastalerz, R., Per-Olof Widmark, Roos, B., Lindh, R. & Reiher, M., 2010, I : Journal of Chemical Physics. 133, 14, 144111.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  13. Bulk simulation of polar liquids in spherical symmetry.

    Joakim Stenhammar, Linse, P. & Gunnar Karlström, 2010, I : Journal of Chemical Physics. 132, 10, 104507.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  14. Charge transfer between the Au(111) surface and adsorbed C-60: Resonant photoemission and new core-hole decay channels

    Britton, A. J., Rienzo, A., O'Shea, J. N. & Karina Schulte, 2010, I : Journal of Chemical Physics. 133, 9

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  15. Correlation energy functional and potential from time-dependent exact-exchange theory.

    Hellgren, M. & Ulf von Barth, 2010, I : Journal of Chemical Physics. 132, 4, 044101.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  16. Depletion interaction between spheres in an ideal equilibrium polymer fluid: Exact asymptotic results

    Woodward, C. E. & Jan Forsman, 2010, I : Journal of Chemical Physics. 133, 15, 154902.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  17. Double-quantum two-dimensional electronic spectroscopy of a three-level system: Experiments and simulations

    Nemeth, A., Milota, F., Mancal, T., Tönu Pullerits, Sperling, J., Hauer, J., Kauffmann, H. F. & Christensson, N., 2010, I : Journal of Chemical Physics. 133, 9

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  18. Dressed counterions: Strong electrostatic coupling in the presence of salt

    Kanduc, M., Naji, A., Jan Forsman & Podgornik, R., 2010, I : Journal of Chemical Physics. 132, 12, 124701.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  19. Nuclear motion in carbonyl sulfide induced by resonant core electron excitation

    Laksman, J., Céolin, D., Mathieu Gisselbrecht & Stacey Ristinmaa Sörensen, 2010, I : Journal of Chemical Physics. 133, 14, s. 144314-1-144314-6

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  20. Retardation effects breaking long-range orientational ordering in dipolar fluids.

    Gunnar Karlström & Linse, P., 2010, I : Journal of Chemical Physics. 132, 5, 054505.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  21. Simulations of high-dielectric Stockmayer fluids in hyperspherical geometry.

    Martin Trulsson, 2010, I : Journal of Chemical Physics. 133, 17, 174105.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  22. Sulfur K-edge photofragmentation of ethylene sulfide

    Stolte, W. C. & Gunnar Öhrwall, 2010, I : Journal of Chemical Physics. 133, 1

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  23. Two-center potential correlations and its use to determine effective ion-ion interactions and dielectric permittivities in dipolar solvents

    Gunnar Karlström, Linse, P. & Woodward, C. E., 2010, I : Journal of Chemical Physics. 132, 8, 084508.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  24. Valence photoelectron spectroscopy of N-2 and CO: Recoil-induced rotational excitation, relative intensities, and atomic orbital composition of molecular orbitals

    Thomas, T. D., Kukk, E., Ouchi, T., Yamada, A., Fukuzawa, H., Ueda, K., Puettner, R., Higuchi, I., Tamenori, Y., Asahina, T., Kuze, N., Kato, H., Hoshino, M., Tanaka, H., Lindblad, A. & Saethre, L. J., 2010, I : Journal of Chemical Physics. 133, 17, 174312.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  25. Weakly chirped pulses in frequency resolved coherent spectroscopy.

    Christensson, N., Avlasevich, Y., Arkady Yartsev, Müllen, K., Torbjörn Pascher & Tönu Pullerits, 2010, I : Journal of Chemical Physics. 132, 17, s. 174508-1-174508-10

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  26. X-ray absorption and photoemission spectroscopy of zinc protoporphyrin adsorbed on rutile TiO2(110) prepared by in situ electrospray deposition

    Rienzo, A., Mayor, L. C., Magnano, G., Satterley, C. J., Ataman, E., Joachim Schnadt, Karina Schulte & O'Shea, J. N., 2010, I : Journal of Chemical Physics. 132, 8

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  27. 2009
  28. Structural analysis of ultrafast extended x-ray absorption fine structure with subpicometer spatial resolution: Application to spin crossover complexes

    Gawelda, W., Van Der Veen, R. M., Grolimund, D., Abela, R., Chergui, M., Bressler, C. & Van-Thai Pham, 2009 apr 8, I : Journal of Chemical Physics. 130, 12, 124520.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  29. A dose dependence study of O-2 adsorbed on large Ar clusters

    Rander, T., Lindblad, A., Lundwall, M., Maxim Tchaplyguine, Ohrwall, G., Svensson, S. & Bjorneholm, O., 2009, I : Journal of Chemical Physics. 130, 22

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  30. Adsorption of a Ru(II) dye complex on the Au(111) surface: Photoemission and scanning tunneling microscopy

    Mayor, L. C., Saywell, A., Magnano, G., Satterley, C. J., Joachim Schnadt & O'Shea, J. N., 2009, I : Journal of Chemical Physics. 130, 164704.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  31. Adsorption of intact methanol on Ru(0001)

    Gazdzicki, P., Per Uvdal & Jakob, P., 2009, I : Journal of Chemical Physics. 130, 22, 224703.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  32. An ab initio investigation of the mechanisms of photodissociation in bromobenzene and iodobenzene

    Chen, S-F., Liu, F-Y. & Liu, Y-J., 2009, I : Journal of Chemical Physics. 131, 12

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  33. Atomic Cholesky decompositions: A route to unbiased auxiliary basis sets for density fitting approximation with tunable accuracy and efficiency

    Aquilante, F., Gagliardi, L., Pedersen, T. & Lindh, R., 2009, I : Journal of Chemical Physics. 130, 15

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  34. Bubble merging in breathing DNA as a vicious walker problem in opposite potentials.

    Pedersen, J., Hansen, M. S., Novotný, T., Tobias Ambjörnsson & Metzler, R., 2009, I : Journal of Chemical Physics. 130, 16, 164117.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  35. Density functional theories of surface interactions in salt solutions

    Jan Forsman, 2009, I : Journal of Chemical Physics. 130, 6

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  36. Dissociation of water on oxygen-covered Rh{111}

    Shavorskiy, A., Eralp, T., Ataman, E., Isvoranu, C., Joachim Schnadt, Andersen, J. N. & Held, G., 2009, I : Journal of Chemical Physics. 131, 21

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  37. Dynamics of proton migration and dissociation in core-excited ethyne probed by multiple ion momentum imaging

    Laksman, J., Céolin, D., Mathieu Gisselbrecht, Canton, S. & Stacey Ristinmaa Sörensen, 2009, I : Journal of Chemical Physics. 131, 24, s. 244305-1-244305-4

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  38. Efficient solution of the self-consistent field theory for block copolymer fluids displaying Schulz-Flory polydispersity

    Woodward, C. E. & Jan Forsman, 2009, I : Journal of Chemical Physics. 130, 24

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  39. Electric multipole moment fluctuations in polar liquids.

    Joakim Stenhammar, Linse, P., Per-Åke Malmqvist & Gunnar Karlström, 2009, I : Journal of Chemical Physics. 130, 12, 124521.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  40. Electron spectroscopy study of the initial stages of iron phthalocyanine growth on highly oriented pyrolitic graphite.

    Isvoranu, C., Ahlund, J., Wang, B., Ataman, E., Mårtensson, N., Puglia, C., Andersen, J. N., Bocquet, M-L. & Joachim Schnadt, 2009, I : Journal of Chemical Physics. 131, 21, 214709.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  41. Exact-exchange kernel of time-dependent density functional theory: Frequency dependence and photoabsorption spectra of atoms

    Hellgren, M. & Ulf von Barth, 2009, I : Journal of Chemical Physics. 131, 4, 044110.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  42. Experimental investigation of the Rb-85(2) a (3)Sigma(+)(u) triplet ground state: Multiparameter Morse long range potential analysis

    Beser, B., Sovkov, V. B., Bai, J., Ahmed, E. H., Tsai, C. C., Xie, F., Li, L., Ivanov, V. S. & Lyyra, M., 2009, I : Journal of Chemical Physics. 131, 9

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  43. Fragmentation properties of three-membered heterocyclic molecules by partial ion yield spectroscopy: C2H4O and C2H4S

    Stolte, W. C., Dumitriu, I., Yu, S. -W., Gunnar Öhrwall, Piancastelli, M. N. & Lindle, D. W., 2009, I : Journal of Chemical Physics. 131, 17, 174306.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  44. Ion-specific thermodynamics of multicomponent electrolytes: A hybrid HNC/MD approach

    Vrbka, L., Mikael Lund, Kalcher, I., Dzubiella, J., Netz, R. R. & Kunz, W., 2009, I : Journal of Chemical Physics. 131, 15

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  45. Large variations in the propensity of aqueous oxychlorine anions for the solution/vapor interface

    Ottosson, N., Vacha, R., Aziz, E. F., Pokapanich, W., Eberhardt, W., Svensson, S., Gunnar Öhrwall, Jungwirth, P., Bjorneholm, O. & Winter, B., 2009, I : Journal of Chemical Physics. 131, 12

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  46. Near-infrared photoabsorption by C-60 dianions in a storage ring

    Kadhane, U., Andersen, J. U., Bonderup, E., Concina, B., Hvelplund, P., Kirketerp, M. -B. S., Liu, B., Nielsen, S. B., Panja, S., Rangama, J., Stochkel, K., Tomita, S., Zettergren, H., Hansen, K., Sunden, A. E. K., Canton, S., Echt, O. & Forster, J. S., 2009, I : Journal of Chemical Physics. 131, 1

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  47. Nondielectric long-range solvation of polar liquids in cubic symmetry

    Joakim Stenhammar, Linse, P. & Gunnar Karlström, 2009, I : Journal of Chemical Physics. 131, 16, 164507.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  48. On the importance of vibrational contributions to small-angle optical rotation: Fluoro-oxirane in gas phase and solution.

    Pedersen, T., Kongsted, J., Crawford, T. D. & Ruud, K., 2009, I : Journal of Chemical Physics. 130, 3, 034310.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  49. Probing the strength of the system-bath interaction by three-pulse photon echoes.

    Christensson, N., Dietzek, B., Arkady Yartsev & Tönu Pullerits, 2009, I : Journal of Chemical Physics. 130, 2, 024510.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  50. Surface enhanced Raman scattering of pyridine adsorbed on Au@Pd core/shell nanoparticles

    Yang, Z., Li, Y., Li, Z., Wu, D., Kang, J., Xu, H. & Sun, M., 2009, I : Journal of Chemical Physics. 130, 23, 234705.

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

  51. Systematic truncation of the virtual space in multiconfigurational perturbation theory

    Aquilante, F., Todorova, T. K., Gagliardi, L., Pedersen, T. & Roos, B., 2009, I : Journal of Chemical Physics. 131, 3

    Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift