Physical Chemistry Chemical Physics

ISSNs: 1463-9076

Additional searchable ISSN (Electronic): 1463-9084

Special Publications of the Royal Society of Chemistry, vol. 197, United Kingdom

BFI (2018): BFI-level 2, Scopus rating (2016): CiteScore 4.06 SJR 1.678 SNIP 1.117, ISI indexed (2013): ISI indexed yes, Web of Science (2018): Indexed yes

Central database

Journal

  1. 2018
  2. Accepted/In press

    Ab initio calculations and kinetic modeling of thermal conversion of methyl chloride: implications for gasification of biomass. / Singla, Mallika; Rasmussen, Morten Lund; Hashemi, Hamid; Wu, Hao; Glarborg, Peter; Pelucchi, Matteo; Faravelli, Tiziano; Marshall, Paul.

    In: Physical Chemistry Chemical Physics, 2018.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  3. Published

    Ab initio study of the CO-N2 complex: a new highly accurate intermolecular potential energy surface and rovibrational spectrum. / Cybulski, Hubert; Henriksen, Christian; Dawes, Richard; Wang, Xiao-Gang; Bora, Neha; Avila, Gustavo; Carrington, Tucker; Fernández, Berta.

    In: Physical Chemistry Chemical Physics, 2018.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  4. Published
  5. Accepted/In press

    Energy vs. density on paths toward exact density functionals. / Kepp, Kasper Planeta.

    In: Physical Chemistry Chemical Physics, 2018.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  6. Published

    High-resolution synchrotron terahertz investigation of the large-amplitude hydrogen bond librational band of (HCN)2. / Mihrin, Dmytro; Jakobsen, P. W. ; Voute, A.; Manceron, L.; Larsen, R. Wugt.

    In: Physical Chemistry Chemical Physics, Vol. 20, No. 12, 2018, p. 8241-8246.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  7. Published

    Magnetic and transport properties of conjugated and cumulated molecules: the π-system enlightens part of the story. / Sarbadhikary, Prodipta; Shil, Suranjan; Misra, Anirban.

    In: Physical Chemistry Chemical Physics, Vol. 20, No. 14, 2018, p. 9364-9375.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  8. Published

    Solvent control of charge transfer excited state relaxation pathways in [Fe(2,2 '-bipyridine)(CN)4]2-. / Kjær, Kasper Skov; Kunnus, Kristjan; Harlang, Tobias C. B.; Van Driel, Tim B.; Ledbetter, Kathryn; Hartsock, Robert W.; Reinhard, Marco E.; Koroidov, Sergey; Li, Lin; Laursen, Mads G.; Biasin, Elisa; Hansen, Frederik B.; Vester, Peter; Christensen, Morten; Haldrup, Kristoffer; Nielsen, Martin M.; Chabera, Pavel; Liu, Yizhu; Tatsuno, Hideyuki; Timm, Cornelia; Uhlig, Jens; Sundstöm, Villy; Nemeth, Zoltan; Szemes, Dorottya Sarosine; Bajnoczi, Eva; Vanko, Gyorgy; Alonso-Mori, Roberto; Glownia, James M.; Nelson, Silke; Sikorski, Marcin; Sokaras, Dimosthenis; Lemke, Henrik T.; Canton, Sophie E.; Warnmark, Kenneth; Persson, Petter; Cordones, Amy A.; Gaffney, Kelly J.

    In: Physical Chemistry Chemical Physics, Vol. 20, No. 6, 2018, p. 4238-4249.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  9. Published

    Water thermophoresis in carbon nanotubes: the interplay between thermophoretic and friction forces. / Oyarzua, Elton; Walther, Jens Honore; Zambrano, Harvey A.

    In: Physical Chemistry Chemical Physics, Vol. 20, 2018, p. 3672-3677 .

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  10. 2017
  11. Published

    A combined UHV-STM-flow cell set-up for electrochemical/electrocatalytic studies of structurally well-defined UHV prepared model electrodes. / Schnaidt, J.; Beckord, S.; Engstfeld, Albert Kilian; Klein, Jörn; Brimaud, S.; Behm, R. J.

    In: Physical Chemistry Chemical Physics, Vol. 19, No. 6, 2017, p. 4166-4178.

    Publication: Research - peer-reviewJournal article – Annual report year: 2017

  12. Published

    Addressing uncertainty in atomistic machine learning. / Peterson, Andrew A. ; Christensen, Rune; Khorshidi, Alireza .

    In: Physical Chemistry Chemical Physics, Vol. 2017, No. 18, 2017, p. 10978-10985.

    Publication: Research - peer-reviewJournal article – Annual report year: 2017

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