Journal of Chemical Physics, 0021-9606

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  1. Debate/Note/Editorial

  2. Comment on "Electronic structure of C-60 on Au(887)" [J. Chem. Phys. 125, 144719 (2006)]

    Schiessling, J. & Bruhwiler, P. A., 2007, In : Journal of Chemical Physics. 127, 6

    Research output: Contribution to journal › Debate/Note/Editorial

  3. Letter

  4. Lifetime and predissociation yield of N-14(2) b (1)Pi(u)(v=1) revisited: Effects of rotation

    Lewis, BR., Gibson, ST., Sprengers, JP., Ubachs, W., Johansson, A. & Claes-Göran Wahlström, 2005, In : Journal of Chemical Physics. 123, 23

    Research output: Contribution to journal › Letter

  5. A 1 : 1 complex between a hydroxyl radical and ozone

    Anders Engdahl & Nelander, B., 2005, In : Journal of Chemical Physics. 122, 12

    Research output: Contribution to journal › Letter

  6. N1s x-ray Absorption Study of the Bonding Interaction of Bi-Isonicotinic Acid on Rutile TiO2 (110)

    Petter Persson, Lunell, S., Bruhwiler, P. A., Schnadt, J., Södergren, S., O'Shea, J. N., Karis, O., Siegbahn, H., Mårtensson, N., Bässler, M. & Patthey, L., 2000, In : Journal of Chemical Physics. 112, 9, p. 3945-3948

    Research output: Contribution to journal › Letter

  7. Article

  8. Tracing charge transfer in argon dimers by XUV-pump IR-probe experiments at FLASH

    Schmid, G., Schnorr, K., Augustin, S., Meister, S., Lindenblatt, H., Trost, F., Liu, Y., Miteva, T., Mathieu Gisselbrecht, Düsterer, S., Redlin, H., Treusch, R., Gokhberg, K., Kuleff, A. I., Cederbaum, L. S., Schröter, C. D., Pfeifer, T. & Moshammer, R., 2019 Aug 28, In : Journal of Chemical Physics. 151, 8, 084314.

    Research output: Contribution to journal › Article

  9. Resonant inelastic X-ray scattering of a Ru photosensitizer: Insights from individual ligands to the electronic structure of the complete molecule

    Temperton, R. H., Skowron, S. T., Handrup, K., Gibson, A. J., Nicolaou, A., Jaouen, N., Besley, E. & O'Shea, J. N., 2019 Aug 21, In : Journal of Chemical Physics. 151, 7, 074701.

    Research output: Contribution to journal › Article

  10. Potential pitfalls of the early-time dynamics in two-dimensional electronic spectroscopy

    Paleček, D., Edlund, P., Gustavsson, E., Westenhoff, S. & Donatas Zigmantas, 2019 Jul 10, In : Journal of Chemical Physics. 151, 2, 024201.

    Research output: Contribution to journal › Article

  11. Many-body effects in a binary nano-particle mixture dispersed in ideal polymer solutions

    Nguyen, H. S., Jan Forsman & Woodward, C. E., 2019, In : Journal of Chemical Physics. 150, 4, 044906.

    Research output: Contribution to journal › Article

  12. Elucidation of the photoaquation reaction mechanism in ferrous hexacyanide using synchrotron x-rays with sub-pulse-duration sensitivity

    March, A. M., Doumy, G., Andersen, A., Al Haddad, A., Kumagai, Y., Tu, M. F., Bang, J., Bostedt, C., Jens Uhlig, Nascimento, D. R., Assefa, T. A., Németh, Z., Vankó, G., Gawelda, W., Govind, N. & Young, L., 2019, In : Journal of Chemical Physics. 151, 14, 144306.

    Research output: Contribution to journal › Article

  13. Coulomb explosion imaging of CH3I and CH2ClI photodissociation dynamics

    Allum, F., Burt, M., Amini, K., Boll, R., Köckert, H., Olshin, P. K., Bari, S., Bomme, C., Brauße, F., Cunha de Miranda, B., Düsterer, S., Erk, B., Géléoc, M., Geneaux, R., Gentleman, A. S., Goldsztejn, G., Guillemin, R., Holland, D. M. P., Ismail, I., Johnsson, P. & 30 others, Journel, L., Küpper, J., Lahl, J., Lee, J. W. L., Maclot, S., Mackenzie, S. R., Manschwetus, B., Mereshchenko, A. S., Mason, R., Palaudoux, J., Piancastelli, M. N., Penent, F., Rompotis, D., Rouzée, A., Ruchon, T., Rudenko, A., Savelyev, E., Simon, M., Schirmel, N., Stapelfeldt, H., Techert, S., Travnikova, O., Trippel, S., Underwood, J. G., Vallance, C., Wiese, J., Ziaee, F., Brouard, M., Marchenko, T. & Rolles, D., 2018 Nov 28, In : Journal of Chemical Physics. 149, 20, p. 204313

    Research output: Contribution to journal › Article

  15. Normal and resonant Auger spectroscopy of isocyanic acid, HNCO

    Holzmeier, F., Wolf, T. J. A., Gienger, C., Wagner, I., Bozek, J., Nandi, S., Nicolas, C., Fischer, I., Gühr, M. & Fink, R. F., 2018 Jul 21, In : Journal of Chemical Physics. 149, 3, 034308.

    Research output: Contribution to journal › Article

  16. Compressibility of the protein-water interface

    Filip Persson & Bertil Halle, 2018 Jun 7, In : Journal of Chemical Physics. 148, 21, 215102.

    Research output: Contribution to journal › Article

  17. How proteins modify water dynamics

    Filip Persson, Pär Söderhjelm & Bertil Halle, 2018 Jun 7, In : Journal of Chemical Physics. 148, 21, 215103.

    Research output: Contribution to journal › Article

  18. The geometry of protein hydration

    Filip Persson, Pär Söderhjelm & Bertil Halle, 2018 Jun 7, In : Journal of Chemical Physics. 148, 21, 215101.

    Research output: Contribution to journal › Article

  19. The spatial range of protein hydration

    Filip Persson, Pär Söderhjelm & Bertil Halle, 2018 Jun 7, In : Journal of Chemical Physics. 148, 21, 215104.

    Research output: Contribution to journal › Article

  20. Multiconfigurational short-range density-functional theory for open-shell systems

    Erik Donovan Hedegård, Toulouse, J. & Jensen, H. J. A., 2018 Jun 7, In : Journal of Chemical Physics. 148, 21, 214103.

    Research output: Contribution to journal › Article

  21. Ultra-fast intramolecular vibronic coupling revealed by RIXS and RPES maps of an aromatic adsorbate on TiO2(110)

    O'Shea, J. N., Handrup, K., Temperton, R. H., Gibson, A. J., Nicolaou, A., Jaouen, N., Taylor, J. B., Mayor, L. C., Swarbrick, J. C. & Joachim Schnadt, 2018 May 28, In : Journal of Chemical Physics. 148, 20, 204705.

    Research output: Contribution to journal › Article

  22. A classical density functional theory for the asymmetric restricted primitive model of ionic liquids

    Lu, H., Nordholm, S., Woodward, C. E. & Jan Forsman, 2018 May 21, In : Journal of Chemical Physics. 148, 19, 193814.

    Research output: Contribution to journal › Article

  23. Two-dimensional Fano lineshapes: Excited-state absorption contributions

    Daniel Finkelstein-Shapiro, Tõnu Pullerits & Hansen, T., 2018 May 14, In : Journal of Chemical Physics. 148, 18, 184201.

    Research output: Contribution to journal › Article

  24. Anomalous surface behavior of hydrated guanidinium ions due to ion pairing

    Ekholm, V., Vazdar, M., Mason, P. E., Bialik, E., Walz, M. M., Gunnar Öhrwall, Werner, J., Rubensson, J. E., Jungwirth, P. & Björneholm, O., 2018 Apr 14, In : Journal of Chemical Physics. 148, 14, 144508.

    Research output: Contribution to journal › Article

  25. Short- and long-time diffusion and dynamic scaling in suspensions of charged colloidal particles

    Banchio, A. J., Heinen, M., Peter Holmqvist & Nägele, G., 2018 Apr 7, In : Journal of Chemical Physics. 148, 13, 134902.

    Research output: Contribution to journal › Article

  26. Cumulant expansions for measuring water exchange using diffusion MRI

    Ning, L., Markus Nilsson, Lasič, S., Westin, C. F. & Rathi, Y., 2018 Feb 21, In : Journal of Chemical Physics. 148, 7, 074109.

    Research output: Contribution to journal › Article

  27. A theoretical and experimental benchmark study of core-excited states in nitrogen

    Myhre, R. H., Wolf, T. J. A., Cheng, L., Nandi, S., Coriani, S., Gühr, M. & Koch, H., 2018 Feb 14, In : Journal of Chemical Physics. 148, 6, 064106.

    Research output: Contribution to journal › Article

  28. Markov modeling of peptide folding in the presence of protein crowders

    Daniel Nilsson, Mohanty, S. & Anders Irbäck, 2018 Feb 7, In : Journal of Chemical Physics. 148, 5, 055101.

    Research output: Contribution to journal › Article

  30. New compact density matrix averaged ANO basis sets for relativistic calculations

    Per Olof Widmark, J. Patrick Zobel, Vysotskiy, V. P., Tsuchiya, T. & Valera Veryazov, 2018, In : Journal of Chemical Physics. 149, 19, 194102.

    Research output: Contribution to journal › Article

  31. Stochastic unfolding of nanoconfined DNA: Experiments, model and Bayesian analysis

    Jens Krog, Alizadehheidari, M., Werner, E., Bikkarolla, S. K., Jonas O. Tegenfeldt, Mehlig, B., Lomholt, M. A., Westerlund, F. & Tobias Ambjörnsson, 2018, In : Journal of Chemical Physics. 149, 21, 215101.

    Research output: Contribution to journal › Article

  32. Coarse-grained model of titrating peptides interacting with lipid bilayers

    Giulio Tesei, Vazdar, M. & Mikael Lund, 2018, In : The Journal of chemical physics. 149, 24, 244108.

    Research output: Contribution to journal › Article

  33. Photofragmentation of gas-phase acetic acid and acetamide clusters in the vacuum ultraviolet region

    Berholts, M., Myllynen, H., Kooser, K., Itälä, E., Granroth, S., Levola, H., Laksman, J., Oghbaiee, S., Oostenrijk, B., Nõmmiste, E. & Kukk, E., 2017 Nov 21, In : Journal of Chemical Physics. 147, 19, 194302.

    Research output: Contribution to journal › Article

  34. Exploring ultra-fast charge transfer and vibronic coupling with N 1s RIXS maps of an aromatic molecule coupled to a semiconductor

    O'Shea, J. N., Handrup, K., Temperton, R. H., Gibson, A. J., Nicolaou, A. & Jaouen, N., 2017 Oct 7, In : Journal of Chemical Physics. 147, 13, 134705.

    Research output: Contribution to journal › Article

  35. Nuclear magnetic relaxation by the dipolar EMOR mechanism: Multi-spin systems

    Chang, Z. & Bertil Halle, 2017 Aug 28, In : Journal of Chemical Physics. 147, 8, 084203.

    Research output: Contribution to journal › Article

  36. Adsorption and charge transfer interactions of bi-isonicotinic acid on Ag(111)

    Temperton, R. H., Gibson, A. J., Handrup, K. & O'Shea, J. N., 2017 Aug 7, In : Journal of Chemical Physics. 147, 5, 054703.

    Research output: Contribution to journal › Article

  37. Alignment, orientation, and Coulomb explosion of difluoroiodobenzene studied with the pixel imaging mass spectrometry (PImMS) camera

    Amini, K., Boll, R., Lauer, A., Burt, M., Lee, J. W. L., Christensen, L., Brauβe, F., Mullins, T., Savelyev, E., Ablikim, U., Berrah, N., Bomme, C., Düsterer, S., Erk, B., Höppner, H., Johnsson, P., Kierspel, T., Krecinic, F., Küpper, J., Müller, M. & 16 others, Müller, E., Redlin, H., Rouzée, A., Schirmel, N., Thøgersen, J., Techert, S., Toleikis, S., Treusch, R., Trippel, S., Ulmer, A., Wiese, J., Vallance, C., Rudenko, A., Stapelfeldt, H., Brouard, M. & Rolles, D., 2017 Jul 7, In : Journal of Chemical Physics. 147, 1, 013933.

    Research output: Contribution to journal › Article

  38. Competition between weak OH·π and CH·O hydrogen bonds: THz spectroscopy of the C2H2 - H2O and C2H4 - H2O complexes

    Andersen, J., Heimdal, J., Nelander, B. & Wugt Larsen, R., 2017 May 21, In : Journal of Chemical Physics. 146, 19, 194302.

    Research output: Contribution to journal › Article

  39. Ion pairing and phase behaviour of an asymmetric restricted primitive model of ionic liquids

    Lu, H., Li, B., Nordholm, S., Woodward, C. E. & Jan Forsman, 2016 Dec 21, In : Journal of Chemical Physics. 145, 23, 234510.

    Research output: Contribution to journal › Article

  40. Electronic ground state of Ni 2 +

    Zamudio-Bayer, V., Lindblad, R., Bülow, C., Leistner, G., Terasaki, A., Issendorff, B. V. & Lau, J. T., 2016 Nov 21, In : Journal of Chemical Physics. 145, 19, 194302.

    Research output: Contribution to journal › Article

  43. Nuclear magnetic relaxation by the dipolar EMOR mechanism: Three-spin systems

    Chang, Z. & Bertil Halle, 2016 Jul 21, In : Journal of Chemical Physics. 145, 3, 034202.

    Research output: Contribution to journal › Article

  44. Microscopic origin of the charge transfer in single crystals based on thiophene derivatives: A combined NEXAFS and density functional theory approach

    Chernenkaya, A., Morherr, A., Backes, S., Popp, W., Witt, S., Kozina, X., Nepijko, S. A., Bolte, M., Medjanik, K., G. Öhrwall, Krellner, C., Baumgarten, M., Elmers, H. J., Schönhense, G., Jeschke, H. O. & Valentí, R., 2016 Jul 21, In : Journal of Chemical Physics. 145, 3, 034702.

    Research output: Contribution to journal › Article

  45. Analytical correlation functions for motion through diffusivity landscapes

    Felix Roosen-Runge, Bicout, D. J. & Barrat, J. L., 2016 May 28, In : Journal of Chemical Physics. 144, 20, 204109.

    Research output: Contribution to journal › Article

  46. Peptide folding in the presence of interacting protein crowders

    Bille, A., Mohanty, S. & Anders Irbäck, 2016 May 7, In : Journal of Chemical Physics. 144, 17, 175105.

    Research output: Contribution to journal › Article

  47. The structure of liquid water up to 360 MPa from x-ray diffraction measurements using a high Q-range and from molecular simulation

    Skinner, L. B., Galib, M., Fulton, J. L., Mundy, C. J., Parise, J. B., Van-Thai Pham, Schenter, G. K. & Benmore, C. J., 2016 Apr 7, In : Journal of Chemical Physics. 144, 13, 134504.

    Research output: Contribution to journal › Article

  48. Iron phthalocyanine on Cu(111): Coverage-dependent assembly and symmetry breaking, temperature-induced homocoupling, and modification of the adsorbate-surface interaction by annealing.

    Snezhkova, O., Bischoff, F., He, Y., Wiengarten, A., Chaudhary, S., Johansson, N., Karina Schulte, Jan Knudsen, Barth, J. V., Seufert, K., Auwärter, W. & Joachim Schnadt, 2016, In : Journal of Chemical Physics. 144, 9, 094702.

    Research output: Contribution to journal › Article

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

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

    Research output: Contribution to journal › Article

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

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

    Research output: Contribution to journal › Article

  52. Coherence and population dynamics of chlorophyll excitations in FCP complex: Two-dimensional spectroscopy study.

    Butkus, V., Gelzinis, A., Augulis, R., Gall, A., Büchel, C., Robert, B., Donatas Zigmantas, Valkunas, L. & Abramavicius, D., 2015, In : Journal of Chemical Physics. 142, 21, 212414.

    Research output: Contribution to journal › Article

  53. 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 others, Harada, Y., Bogan, M. J., Wernet, P., Föhlisch, A., Pettersson, L. G. M. & Nilsson, A., 2015, In : Journal of Chemical Physics. 142, 4, 044505.

    Research output: Contribution to journal › Article

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