Physical chemistry chemical physics : PCCP, 1463-9084

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  1. 2019
  2. Multi-particle momentum correlations extracted using covariance methods on multiple-ionization of diiodomethane molecules by soft-X-ray free-electron laser pulses

    You, D., Fukuzawa, H., Luo, Y., Saito, S., Berholts, M., Gaumnitz, T., Huttula, M., Johnsson, P., Kishimoto, N., Myllynen, H., Nemer, A., Niozu, A., Patanen, M., Pelimanni, E., Takanashi, T., Wada, S-I., Yokono, N., Owada, S., Tono, K., Yabashi, M. & 3 othersNagaya, K., Kukk, E. & Ueda, K., 2019 Aug 22, In : Physical chemistry chemical physics : PCCP.

    Research output: Contribution to journalArticle

  3. Adsorption, surface relaxation and electrolyte structure at Pt(111) electrodes in non-aqueous and aqueous acetonitrile electrolytes

    Gary S. Harlow, M. Aldous, I., Thompson, P., Gründer, Y., J. Hardwick, L. & A. Lucas, C., 2019, In : Physical Chemistry Chemical Physics. 21, 17, p. 8654-8662 9 p.

    Research output: Contribution to journalArticle

  4. Bayesian determination of the effect of a deep eutectic solvent on the structure of lipid monolayers

    McCluskey, A. R., Adrian Sanchez-Fernandez, Edler, K. J., Parker, S. C., Andrew J. Jackson, Campbell, R. A. & Arnold, T., 2019, In : Physical Chemistry Chemical Physics. 21, 11, p. 6133-6141 9 p.

    Research output: Contribution to journalArticle

  5. Block copolymers as bile salt sequestrants: Intriguing structures formed in a mixture of an oppositely charged amphiphilic block copolymer and bile salt

    Karin Schillén, Galantini, L., Guanqun Du, Del Giudice, A., Viveka Alfredsson, Carnerup, A. M., Pavel, N. V., Masci, G. & Nyström, B., 2019, In : Physical Chemistry Chemical Physics. 21, 23, p. 12518-12529 12 p.

    Research output: Contribution to journalArticle

  6. Experimental and theoretical 2p core-level spectra of size-selected gas-phase aluminum and silicon cluster cations: Chemical shifts, geometric structure, and coordination-dependent screening

    Walter, M., Vogel, M., Zamudio-Bayer, V., Lindblad, R., Reichenbach, T., Hirsch, K., Langenberg, A., Rittmann, J., Kulesza, A., Mitrić, R., Moseler, M., Möller, T., Von Issendorff, B. & Lau, J. T., 2019, In : Physical Chemistry Chemical Physics. 21, 12, p. 6651-6661 11 p.

    Research output: Contribution to journalArticle

  7. Extremely large differences in DFT energies for nitrogenase models

    Lili Cao & Ulf Ryde, 2019, In : Physical Chemistry Chemical Physics. 21, 5, p. 2480-2488 9 p.

    Research output: Contribution to journalArticle

  8. Influence of polar co-solutes and salt on the hydration of lipid membranes

    Wolde-Kidan, A., Quoc Dat Pham, Schlaich, A., Loche, P., Emma Sparr, Netz, R. R. & Schneck, E., 2019, In : Physical Chemistry Chemical Physics. 21, 31, p. 16989-17000 12 p.

    Research output: Contribution to journalArticle

  9. Stability and behaviour in aqueous solutions of the anionic cubic silsesquioxane substituted with tetramethylammonium

    Nilsson, E. J., Huber, M., Carlström, G., Olle Söderman, Bowron, D. T., Edler, K. J. & Viveka Alfredsson, 2019, In : Physical Chemistry Chemical Physics. 21, 12, p. 6732-6742 11 p.

    Research output: Contribution to journalArticle

  10. Tin-oxide nanoparticles deposited from a beam: what happens to the composition?

    M. Tchaplyguine, Wright, C., A. Shavorskiy, Zhu, S., M. H. Mikkelä, Zhang, C., Björneholm, O., Mårsell, E., A. Mikkelsen, S. Sorensen, C. J.D. Hetherington & L. R. Wallenberg, 2019, In : Physical chemistry chemical physics : PCCP. 21, 11, p. 6287-6295 9 p.

    Research output: Contribution to journalArticle

  11. Visualizing the coordination-spheres of photoexcited transition metal complexes with ultrafast hard X-rays

    Khakhulin, D., Lawson Daku, L. M., Leshchev, D., Newby, G. E., M. Jarenmark, Bressler, C., Wulff, M. & Canton, S. E., 2019, In : Physical Chemistry Chemical Physics. 21, 18, p. 9277-9284 8 p.

    Research output: Contribution to journalArticle

  12. 2018
  13. Bayesian analysis of single-particle tracking data using the nested-sampling algorithm: maximum-likelihood model selection applied to stochastic-diffusivity data

    Thapa, S., Lomholt, M. A., Jens Krog, Cherstvy, A. G. & Metzler, R., 2018 Sep 11, In : Physical Chemistry Chemical Physics. 20, 46, p. 29018-29037

    Research output: Contribution to journalArticle

  14. Evaporation, diffusion and self-assembly at drying interfaces

    Roger, K., E. Sparr & H. Wennerström, 2018 Jan 1, In : Physical Chemistry Chemical Physics. 20, 15, p. 10430-10438 9 p.

    Research output: Contribution to journalArticle

  15. Shifted equilibria of organic acids and bases in the aqueous surface region

    Werner, J., Persson, I., Björneholm, O., Kawecki, D., Saak, C. M., Walz, M. M., Ekholm, V., Unger, I., Valtl, C., Caleman, C., Gunnar Öhrwall & Prisle, N. L., 2018 Jan 1, In : Physical Chemistry Chemical Physics. 20, 36, p. 23281-23293 13 p.

    Research output: Contribution to journalArticle

  16. TEMPO-oxidised cellulose nanofibrils; Probing the mechanisms of gelation: Via small angle X-ray scattering

    Schmitt, J., Calabrese, V., Da Silva, M. A., Lindhoud, S., Viveka Alfredsson, Scott, J. L. & Edler, K. J., 2018 Jan 1, In : Physical Chemistry Chemical Physics. 20, 23, p. 16012-16020 9 p.

    Research output: Contribution to journalArticle

  17. Counterion binding alters surfactant self-assembly in deep eutectic solvents

    A. Sanchez-fernandez, Hammond, O. S., Edler, K. J., Arnold, T., Doutch, J., Dalgliesh, R. M., Li, P., Ma, K. & Jackson, A. J., 2018, In : Physical Chemistry Chemical Physics. 20, 20, p. 13952-13961

    Research output: Contribution to journalArticle

  18. Exploration of H2 binding to the [NiFe]-hydrogenase active site with multiconfigurational density functional theory

    Dong, G., Ulf Ryde, Aa Jensen, H. J. & Erik D. Hedegård, 2018, In : Physical Chemistry Chemical Physics. 20, 2, p. 794-801 8 p.

    Research output: Contribution to journalArticle

  19. Light and oxygen induce chain scission of conjugated polymers in solution

    Boris Louis, Caubergh, S., Per Olof Larsson, Tian, Y. & Ivan G. Scheblykin, 2018, In : Physical Chemistry Chemical Physics. 20, 3, p. 1829-1837 9 p.

    Research output: Contribution to journalArticle

  20. Solvent control of charge transfer excited state relaxation pathways in [Fe(2,2′-bipyridine)(CN)4]2-

    Kjær, K. S., Kunnus, K., Harlang, T. C. B., Van Driel, T. B., Ledbetter, K., Hartsock, R. W., Reinhard, M. E., Koroidov, S., Li, L., Laursen, M. G., Biasin, E., Hansen, F. B., Vester, P., Christensen, M., Haldrup, K., Nielsen, M. M., Chabera, P., Liu, Y., Tatsuno, H., Timm, C. & 17 othersJens Uhlig, Villy Sundstöm, Németh, Z., Szemes, D. S., Bajnóczi, É., Vankó, G., Alonso-Mori, R., Glownia, J. M., Nelson, S., Sikorski, M., Sokaras, D., Lemke, H. T., Canton, S. E., Kenneth Wärnmark, Petter Persson, Cordones, A. A. & Gaffney, K. J., 2018, In : Physical Chemistry Chemical Physics. 20, 6, p. 4238-4249 12 p.

    Research output: Contribution to journalArticle

  21. Thermal reduction of ceria nanostructures on rhodium(111) and re-oxidation by CO2

    Schaefer, A., Benjamin Hagman, Höcker, J., Uta Hejral, Flege, J. I. & Johan Gustafson, 2018, In : Physical Chemistry Chemical Physics. 20, 29, p. 19447-19457 11 p.

    Research output: Contribution to journalArticle

  22. Tuning phase transitions of aqueous protein solutions by multivalent cations

    Matsarskaia, O., Felix Roosen-Runge, Lotze, G., Möller, J., Mariani, A., Zhang, F. & Schreiber, F., 2018, In : Physical chemistry chemical physics : PCCP. 20, 42, p. 27214-27225 12 p.

    Research output: Contribution to journalArticle

  23. 2017
  24. Metal-passivated PbS nanoparticles: Fabrication and characterization

    M. Tchaplyguine, M. H. Mikkelä, Mårsell, E., C. Polley, A. Mikkelsen, Zhang, W., A. Yartsev, C. J D Hetherington, Reine Wallenberg & Björneholm, O., 2017 Feb 17, In : Physical Chemistry Chemical Physics. 19, 10, p. 7252-7261 10 p.

    Research output: Contribution to journalArticle

  25. Beam-profile-compensated quantum yield measurements of upconverting nanoparticles

    Monirehalsadat Mousavi, Thomasson, B., Li, M., Kraft, M., Würth, C., Resch-Genger, U. & Andersson-Engels, S., 2017, In : Physical Chemistry Chemical Physics. 19, 33, p. 22016-22022 7 p.

    Research output: Contribution to journalArticle

  26. Dissociation of cyclopropane in double ionization continuum

    Oghbaie, S., Mathieu Gisselbrecht, Månsson, E., Laksman, J., Strahlman, C., Sankari, A. & Stacey Ristinmaa Sörensen, 2017, In : Physical chemistry chemical physics : PCCP. 19, 30, p. 19631-19639

    Research output: Contribution to journalArticle

  27. Electrostatic interactions in concentrated colloidal dispersions

    Håkan Wennerström, 2017, In : Physical Chemistry Chemical Physics. 19, 35, p. 23849-23853 5 p.

    Research output: Contribution to journalArticle

  28. H2 binding to the active site of [NiFe] hydrogenase studied by multiconfigurational and coupled-cluster methods

    Dong, G., Phung, Q. M., Hallaert, S. D., Pierloot, K. & Ulf Ryde, 2017, In : Physical Chemistry Chemical Physics. 19, 16, p. 10590-10601 12 p.

    Research output: Contribution to journalArticle

  29. Investigating the evolving microstructure of lithium metal electrodes in 3D using X-ray computed tomography

    Taiwo, O. O., Finegan, D. P., Paz-Garcia, J. M., Eastwood, D. S., Bodey, A. J., Rau, D. C., S. A. Hall, Brett, D. J. L., Lee, P. D. & Shearing, P. R., 2017, In : Physical Chemistry Chemical Physics. 19, 33, p. 22111-22120 10 p.

    Research output: Contribution to journalArticle

  30. Lead(ii) soaps: Crystal structures, polymorphism, and solid and liquid mesophases

    Martinez, F., Ramos Riesco, M., Rodríguez-Cheda, J. A., Redondo Yélamos, M. I., Garrido, L., Fernández-Martínez, A., García-Barriocanal, J., da Silva, I., Durán-Olivencia, M. & Poulain, A., 2017, In : Physical Chemistry Chemical Physics. 19, 26, p. 17009-17018 10 p.

    Research output: Contribution to journalArticle

  31. Membrane interactions and antimicrobial effects of layered double hydroxide nanoparticles

    Malekkhaiat-Häffner, S., Nyström, L., Nordström, R., Xu, Z. P., Davoudi, M., A. Schmidtchen & Malmsten, M., 2017, In : Physical Chemistry Chemical Physics. 19, 35, p. 23832-23842 11 p.

    Research output: Contribution to journalArticle

  32. Modeling the absorption spectrum of the permanganate ion in vacuum and in aqueous solution

    Olsen, J. M. H. & Erik Donovan Hedegård, 2017, In : Physical Chemistry Chemical Physics. 19, 24, p. 15870-15875 6 p.

    Research output: Contribution to journalArticle

  33. Probing RbBr solvation in freestanding sub-2 nm water clusters

    Hautala, L., Jänkälä, K., Mikko Heikki Mikkelä, Turunen, P., Prisle, N. L., Patanen, M., Maxim Tchaplyguine & Huttula, M., 2017, In : Physical Chemistry Chemical Physics. 19, 36, p. 25158-25167 10 p.

    Research output: Contribution to journalArticle

  34. Spectroscopic characterization of the on-surface induced (cyclo)dehydrogenation of a N-heteroaromatic compound on noble metal surfaces

    Palacio, I., Lisa Pinardi, A., Martínez-Moyano, I. J., A. Preobrajenski, Cossaro, A., Jancarik, A., Stará, I., Starý, I., Méndez, J., Martín-Gago, J. A. & López, M. F., 2017, In : Physical Chemistry Chemical Physics. 19, 33, p. 22454-22461 8 p.

    Research output: Contribution to journalArticle

  35. Supramolecular assembly of thermoresponsive steroidal surfactant with oppositely charged thermoresponsive block copolymer

    Karin Schillén, di Gregorio, M. C., Gubitosi, M., Travaglini, L., Pavel, N. V., Jover, A., Meijide, F., Tato, J. V., Sennato, S., Tranchini, F., De Santis, S., Masci, G. & Galantini, L., 2017, In : Physical Chemistry Chemical Physics. 19, 2, p. 1504-1515

    Research output: Contribution to journalArticle

  36. Swelling of micro-hydrogels with a crosslinker gradient

    Niels Boon & Peter Schurtenberger, 2017, In : Physical Chemistry Chemical Physics. 19, 35, p. 23740-23746 7 p.

    Research output: Contribution to journalArticle

  37. The relevance of structural features of cellulose and its interactions to dissolution, regeneration, gelation and plasticization phenomena

    Björn Lindman, Medronho, B., Alves, L., Costa, C., Edlund, H. & Norgren, M., 2017, In : Physical Chemistry Chemical Physics. 19, 35, p. 23704-23718 15 p.

    Research output: Contribution to journalReview article

  38. Time-resolved terahertz spectroscopy reveals the influence of charged sensitizing quantum dots on the electron dynamics in ZnO

    Bamini, S., Němec, H., Zidek, K., Abdellah, M., Al-Marri, M. J., Pavel Chábera, Ponseca, C., Kaibo Zheng & Tönu Pullerits, 2017, In : Physical Chemistry Chemical Physics. 19, 8, p. 6006-6012 7 p.

    Research output: Contribution to journalArticle

  39. 2016
  40. Growth and structure of ultrathin praseodymium oxide layers on ruthenium(0001)

    Höcker, J., Krisponeit, J-O., Cambeis, J., Zakharov, A., Yuran Niu, Wei, G., Colombi Ciacchi, L., Falta, J., Schaefer, A. & Flege, J. I., 2016 Nov 2, In : Physical Chemistry Chemical Physics.

    Research output: Contribution to journalArticle

  41. Hydrogen adsorption on two catalysts for the ortho- to parahydrogen conversion: Cr-doped silica and ferric oxide gel

    Hartl, M., Gillis, R. C., Daemen, L., Olds, D. P., Page, K., Stefan Carlson, Cheng, Y., Hügle, T., Iverson, E. B., Ramirez-Cuesta, A. J., Lee, Y. J. & Muhrer, G., 2016 May 5, In : Physical Chemistry Chemical Physics. 18, 26, p. 17281-17293 13 p.

    Research output: Contribution to journalArticle

  42. A neutron scattering and modelling study of aqueous solutions of tetramethylammonium and tetrapropylammonium bromide

    Nilsson, E. J., Viveka Alfredsson, Bowron, D. T. & Edler, K. J., 2016 Apr 28, In : Physical Chemistry Chemical Physics. 18, 16, p. 11193-11201 9 p.

    Research output: Contribution to journalArticle

  43. Theoretical predictions of structures in dispersions containing charged colloidal particles and non-adsorbing polymers

    Xie, F., Turesson, M., Woodward, C. E., Van Gruijthuijsen, K., Anna Stradner & Jan Forsman, 2016 Apr 28, In : Physical Chemistry Chemical Physics. 18, 16, p. 11422-11434 13 p.

    Research output: Contribution to journalArticle

  44. The structure-function relationship for alumina supported platinum during the formation of ammonia from nitrogen oxide and hydrogen in the presence of oxygen

    Adams, E. C., Merte, L. R., Hellman, A., Skoglundh, M., Johan Gustafson, Bendixen, E. C., Gabrielsson, P., Bertram, F., Evertsson, J., Zhang, C., Stefan Carlson & Carlsson, P. A., 2016 Apr 28, In : Physical Chemistry Chemical Physics. 18, 16, p. 10850-10855 6 p.

    Research output: Contribution to journalArticle

  45. Alcohols at the aqueous surface: Chain length and isomer effects

    Walz, M. M., Werner, J., Ekholm, V., Prisle, N. L., G. Öhrwall & Björneholm, O., 2016, In : Physical Chemistry Chemical Physics. 18, 9, p. 6648-6656 9 p.

    Research output: Contribution to journalArticle

  46. A new potassium-based intermediate and its role in the desorption properties of the K-Mg-N-H system.

    Santoru, A., Garroni, S., Pistidda, C., Milanese, C., Girella, A., Marini, A., Masolo, E., Valentoni, A., Bergemann, N., Le, T. T., Cao, H., Haase, D., Olivier Balmes, Taube, K., Mulas, G., Enzo, S., Klassen, T. & Dornheim, M., 2016, In : Physical chemistry chemical physics : PCCP. 18, 5, p. 3910-3920

    Research output: Contribution to journalArticle

  47. Correlating structure and electronic band-edge properties in organolead halide perovskites nanoparticles

    Zhu, Q., Kaibo Zheng, Qenawy, M., Alexander Generalov, Haase, D., Stefan Carlson, Yuran Niu, Heimdal, J., Anders Engdahl, Maria E. Messing, Tönu Pullerits & Canton, S. E., 2016, In : Physical Chemistry Chemical Physics. 18, 22, p. 14933-14940 8 p.

    Research output: Contribution to journalArticle

  48. Density-induced reentrant melting of colloidal Wigner crystals.

    Everts, J. C., Niels Boon & van Roij, R., 2016, In : Physical chemistry chemical physics : PCCP.

    Research output: Contribution to journalArticle

  49. Design and characterisation of bodipy sensitizers for dye-sensitized NiO solar cells.

    Summers, G. H., Lefebvre, J-F., Black, F. A., Stephen Davies, E., Gibson, E. A., Tönu Pullerits, Wood, C. J. & Zidek, K., 2016, In : Physical chemistry chemical physics : PCCP. 18, 2, p. 1059-1070

    Research output: Contribution to journalArticle

  50. Fused coarse-grained model of aromatic ionic liquids and their behaviour at electrodes.

    Li, B., Ma, K., Wang, Y-L., Turesson, M., Woodward, C. E. & Jan Forsman, 2016, In : Physical chemistry chemical physics : PCCP. 18, 11, p. 8165-8173

    Research output: Contribution to journalArticle

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