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Jonas Elm

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  1. 2023
  2. Published
    Significant contributions of trimethylamine to sulfuric acid nucleation in polluted environments. / Cai, Runlong; Yin, Rujing; Li, Xue et al.
    In: npj Climate and Atmospheric Science, Vol. 6, No. 1, 75, 12.2023.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  3. Published
    Nitric Acid and Organic Acids Suppress the Role of Methanesulfonic Acid in Atmospheric New Particle Formation. / Knattrup, Yosef; Kubečka, Jakub; Elm, Jonas.
    In: The journal of physical chemistry. A, Vol. 127, No. 36, 14.09.2023, p. 7568-7578.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  4. Published
    Clusterome: A Comprehensive Data Set of Atmospheric Molecular Clusters for Machine Learning Applications. / Knattrup, Yosef; Kubečka, Jakub; Ayoubi, Daniel et al.
    In: ACS Omega, Vol. 8, No. 28, 07.2023, p. 25155-25164.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  5. Published
    Limited Role of Malonic Acid in Sulfuric Acid-Dimethylamine New Particle Formation. / Fomete, Sandra K.W.; Kubečka, Jakub; Elm, Jonas et al.
    In: ACS Omega, Vol. 8, No. 22, 06.06.2023, p. 19807-19815.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  6. Published
    Current and future machine learning approaches for modeling atmospheric cluster formation. / Kubečka, Jakub; Knattrup, Yosef; Engsvang, Morten et al.
    In: Nature Computational Science, Vol. 3, No. 6, 06.2023, p. 495-503.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  7. Published
    Quantum chemical modeling of organic enhanced atmospheric nucleation: A critical review. / Elm, Jonas; Ayoubi, Daniel; Engsvang, Morten et al.
    In: Wiley Interdisciplinary Reviews: Computational Molecular Science, 09.05.2023.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Review › Research › peer-review

  8. Published
    Enhancement of Atmospheric Nucleation Precursors on Iodic Acid-Induced Nucleation: Predictive Model and Mechanism. / Ma, Fangfang; Xie, Hong-Bin; Zhang, Rongjie et al.
    In: Environmental Science & Technology, Vol. 57, No. 17, 05.2023, p. 6944-6954.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  9. Published
    Atmospheric Sulfuric Acid-Multi-Base New Particle Formation Revealed through Quantum Chemistry Enhanced by Machine Learning. / Kubečka, Jakub; Neefjes, Ivo; Besel, Vitus et al.
    In: The journal of physical chemistry. A, Vol. 127, No. 9, 03.2023, p. 2091-2103.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  10. Published
    Clusteromics V: Organic Enhanced Atmospheric Cluster Formation. / Ayoubi, Daniel; Knattrup, Yosef; Elm, Jonas.
    In: ACS Omega, Vol. 8, No. 10, 03.2023, p. 9621-9629.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  11. Published
    Reducing chemical complexity in representation of new-particle formation: evaluation of simplification approaches. / Olenius, Tinja; Bergström, Robert; Kubečka, Jakub et al.
    In: Environmental Science: Atmospheres, Vol. 2023, No. 3, 03.2023, p. 552-567.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  12. 2022
  13. Published
    Massive Assessment of the Binding Energies of Atmospheric Molecular Clusters. / Jensen, Andreas Buchgraitz; Kubečka, Jakub; Schmitz, Gunnar et al.
    In: Journal of Chemical Theory and Computation, Vol. 18, No. 12, 12.2022, p. 7373-7383.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  14. Published
    Ozonolysis of α-Pinene and Δ3-Carene Mixtures: Formation of Dimers with Two Precursors. / Thomsen, Ditte; Thomsen, Lotte Dyrholm; Iversen, Emil Mark et al.
    In: Environmental Science & Technology, Vol. 56, No. 23, 12.2022, p. 16643-16651.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  15. Published
    Contribution of Methanesulfonic Acid to the Formation of Molecular Clusters in the Marine Atmosphere. / Rasmussen, Freja Rydahl; Kubecka, Jakub; Elm, Jonas.
    In: Journal of Physical Chemistry A, Vol. 126, No. 40, 10.2022, p. 7127–7136.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  16. Published
    Hygroscopicity and CCN potential of DMS-derived aerosol particles. / Rosati, Bernadette; Isokaanta, Sini; Christiansen, Sigurd et al.
    In: Atmospheric Chemistry and Physics, Vol. 22, No. 20, 10.2022, p. 13449-13466.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  17. Published
    Atmospheric oxidation mechanism and kinetics of indole initiated by •OH and •Cl: a computational study. / Xue, Jingwen; Ma, Fangfang; Elm, Jonas et al.
    In: Atmospheric Chemistry and Physics, Vol. 22, No. 17, 09.2022, p. 11543-11555.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  18. Published
    Clusteromics IV: The Role of Nitric Acid in Atmospheric Cluster Formation. / Knattrup, Yosef; Elm, Jonas.
    In: ACS Omega, Vol. 7, No. 35, 09.2022, p. 31551–31560.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  19. Published
    Atmospheric Autoxidation of Organophosphate Esters. / Fu, Zihao; Xie, Hong Bin; Elm, Jonas et al.
    In: Environmental Science and Technology, Vol. 56, No. 11, 06.2022, p. 6944–6955.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  20. Published
    Amine-Enhanced Methanesulfonic Acid-Driven Nucleation: Predictive Model and Cluster Formation Mechanism. / Liu, Yu; Xie, Hong-Bin; Ma, Fangfang et al.
    In: Environmental Science & Technology, Vol. 56, No. 12, 05.2022, p. 7751-7760.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  21. Published
    Clusteromics III: Acid Synergy in Sulfuric Acid-Methanesulfonic Acid-Base Cluster Formation. / Elm, Jonas.
    In: ACS Omega, Vol. 7, No. 17, 05.2022, p. 15206-15214.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  22. Published
    Modeling the Binding Free Energy of Large Atmospheric Sulfuric Acid-Ammonia Clusters. / Engsvang, Morten; Elm, Jonas.
    In: ACS Omega, Vol. 7, No. 9, 08.03.2022, p. 8077-8083.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  23. Published
    Quantum Machine Learning Approach for Studying Atmospheric Cluster Formation. / Kubečka, Jakub; Christensen, Anders S.; Rasmussen, Freja Rydahl et al.
    In: Environmental Science and Technology Letters, Vol. 9, No. 3, 08.03.2022, p. 239-244.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  24. Published
    Real-time monitoring of aerosol particle formation from sulfuric acid vapor at elevated concentrations and temperatures. / Becker, Daniel; Heitland, Jonas; Carlsson, Philip T.M. et al.
    In: Physical Chemistry Chemical Physics, Vol. 24, No. 8, 02.2022, p. 5001-5013.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  25. Published
    The role of organic acids in new particle formation from methanesulfonic acid and methylamine. / Zhang, Rongjie; Shen, Jiewen; Xie, Hong Bin et al.
    In: Atmospheric Chemistry and Physics, Vol. 22, No. 4, 02.2022, p. 2639-2650.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  26. 2021
  27. Published
    Tri-base synergy in sulfuric acid-base clusters. / Xie, Hong Bin; Elm, Jonas.
    In: Atmosphere, Vol. 12, No. 10, 1260, 10.2021.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  28. Published
    Clusteromics II: Methanesulfonic Acid-Base Cluster Formation. / Elm, Jonas.
    In: ACS Omega, Vol. 6, No. 26, 07.2021, p. 17035-17044.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  29. Published
    Secondary aerosol formation from dimethyl sulfide-improved mechanistic understanding based on smog chamber experiments and modelling. / Wollesen De Jonge, Robin; Elm, Jonas; Rosati, Bernadette et al.
    In: Atmospheric Chemistry and Physics, Vol. 21, No. 13, 07.2021, p. 9955-9976.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  30. Published
    Atmospheric Chemistry of Allylic Radicals from Isoprene: A Successive Cyclization-Driven Autoxidation Mechanism. / Ma, Fangfang; Guo, Xirui; Xia, Deming et al.
    In: Environmental Science and Technology, Vol. 55, No. 8, 04.2021, p. 4399-4409.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  31. Published
    New Particle Formation and Growth from Dimethyl Sulfide Oxidation by Hydroxyl Radicals. / Rosati, Bernadette; Christiansen, Sigurd; Wollesen De Jonge, Robin et al.
    In: ACS Earth and Space Chemistry, Vol. 5, No. 4, 04.2021, p. 801-811.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  32. Published
    Clusteromics I: Principles, Protocols, and Applications to Sulfuric Acid-Base Cluster Formation. / Elm, Jonas.
    In: ACS Omega, Vol. 6, No. 11, 03.2021, p. 7804-7814.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  33. Published
    Large Discrepancy in the Formation of Secondary Organic Aerosols from Structurally Similar Monoterpenes. / Thomsen, Ditte; Elm, Jonas; Rosati, Bernadette et al.
    In: ACS Earth and Space Chemistry, Vol. 5, No. 3, 03.2021, p. 632-644.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  34. Published
    Toward a Holistic Understanding of the Formation and Growth of Atmospheric Molecular Clusters: A Quantum Machine Learning Perspective. / Elm, Jonas.
    In: Journal of Physical Chemistry A, Vol. 125, No. 4, 02.2021, p. 895-902.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  35. 2020
  36. Published
    Modeling the formation and growth of atmospheric molecular clusters: A review. / Elm, Jonas; Kubečka, Jakub; Besel, Vitus et al.
    In: Journal of Aerosol Science, Vol. 149, 105621, 11.2020.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  37. Published
    Structural Effects of Amines in Enhancing Methanesulfonic Acid-Driven New Particle Formation. / Shen, Jiewen; Elm, Jonas; Xie, Hong Bin et al.
    In: Environmental Science & Technology, Vol. 54, No. 21, 11.2020, p. 13498-13508.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  38. Published
    Technical note: Estimating aqueous solubilities and activity coefficients of mono- And α,ω-dicarboxylic acids using COSMOtherm. / Hyttinen, Noora; Heshmatnezhad, Reyhaneh; Elm, Jonas et al.
    In: Atmospheric Chemistry and Physics, Vol. 20, No. 21, 11.2020, p. 13131-13143.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  39. Published
    The Aarhus Chamber Campaign on Highly Oxygenated Organic Molecules and Aerosols (ACCHA): Particle formation, organic acids, and dimer esters from α-pinene ozonolysis at different temperatures. / Kristensen, Kasper; N. Jensen, Louise; L. J. Quéléver, Lauriane et al.
    In: Atmospheric Chemistry and Physics, Vol. 20, No. 21, 11.2020, p. 12549-12567.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  40. Published
    The reaction of isotope-substituted hydrated iodide I(H 182O)− with ozone: the reactive influence of the solvent water molecul. / Pedersen, Henrik B.; Elm, Jonas; Frederiksen, Christian H. et al.
    In: Physical Chemistry Chemical Physics, Vol. 22, No. 34, 09.2020, p. 19080-19088.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  41. Published
    Formation of Low-Volatile Products and Unexpected High Formaldehyde Yield from the Atmospheric Oxidation of Methylsiloxanes. / Fu, Zihao; Xie, Hong Bin; Elm, Jonas et al.
    In: Environmental Science & Technology, Vol. 54, No. 12, 06.2020, p. 7136-7145.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  42. Published
    Hydration of Atmospheric Molecular Clusters III: Procedure for Efficient Free Energy Surface Exploration of Large Hydrated Clusters. / Rasmussen, Freja Rydahl; Kubečka, Jakub; Besel, Vitus et al.
    In: The journal of physical chemistry. A, Vol. 124, No. 25, 06.2020, p. 5253-5261.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  43. Published
    Neutral Sulfuric Acid-Water Clustering Rates: Bridging the Gap between Molecular Simulation and Experiment. / Carlsson, Philip T.M.; Celik, Steven; Becker, Daniel et al.
    In: The Journal of Physical Chemistry Letters, Vol. 11, No. 10, 05.2020, p. 4239-4244.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  44. Published
    Thermodynamic properties of isoprene-and monoterpene-derived organosulfates estimated with COSMOtherm. / Hyttinen, Noora; Elm, Jonas; Malila, Jussi et al.
    In: Atmospheric Chemistry and Physics, Vol. 20, No. 9, 05.2020, p. 5679-5696.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  45. Published
    Assessment of the DLPNO Binding Energies of Strongly Noncovalent Bonded Atmospheric Molecular Clusters. / Schmitz, Gunnar; Elm, Jonas.
    In: ACS Omega, Vol. 5, No. 13, 04.2020, p. 7601-7612.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  46. 2019
  47. Published
    Mechanism and predictive model development of reaction rate constants for N-center radicals with O2. / Liu, Cong; Ma, Fangfang; Elm, J. et al.
    In: Chemosphere, Vol. 237, 124411, 12.2019.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  48. Published
    Methanesulfonic Acid-driven New Particle Formation Enhanced by Monoethanolamine: A Computational Study. / Shen, Jiewen; Xie, Hong-Bin; Elm, Jonas et al.
    In: Environmental Science & Technology, Vol. 53, No. 24, 12.2019, p. 14387-14397.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  49. Published
    Reply to the 'Comment on "Atmospheric chemistry of iodine anions: elementary reactions of I-, IO-, and IO-2 with ozone studied in the gas-phase at 300 K using an ion trap"' by D. Britz, Phys. Chem. Chem. Phys., 2019, 21, C9CP03851E. / Teiwes, Ricky; Elm, Jonas; Bilde, Merete et al.
    In: Physical Chemistry Chemical Physics, Vol. 21, No. 40, 10.2019, p. 22656-22656.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Comment/debate/letter to the editor › Research › peer-review

  50. Published
    The role of highly oxygenated organic molecules in the Boreal aerosol-cloud-climate system. / Roldin, Pontus; Ehn, Mikael; Kurtén, Theo et al.
    In: Nature Communications, Vol. 10, No. 1, 4370, 09.2019.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  51. Published
    Benchmarking sampling methodology for calculations of Rayleigh light scattering properties of atmospheric molecular clusters. / Joranger, Teis; Kildgaard, Jens V.; Jorgensen, Solvejg et al.
    In: Physical Chemistry Chemical Physics, Vol. 21, No. 31, 08.2019, p. 17274-17287.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  52. Published
    Piperazine enhancing sulfuric acid-based new particle formation: implications for the atmospheric fate of piperazine. / Ma, Fangfang; Xie, Hong-Bin; Elm, Jonas et al.
    In: Environmental Science & Technology, Vol. 53, No. 15, 08.2019, p. 8785-8795.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  53. Published
    The reaction of hydrated iodide I(H2O)- with ozone: a new route to IO2− products. / Teiwes, Ricky; Elm, Jonas; Bilde, Merete et al.
    In: Physical Chemistry Chemical Physics, Vol. 21, No. 32, 08.2019, p. 17546-17554.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  54. Published
    An atmospheric cluster database consisting of sulfuric acid, bases, organics, and water. / Elm, Jonas.
    In: ACS Omega, Vol. 4, No. 6, 2019, p. 10965-10974.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  55. Published
    Strong Even/Odd Pattern in the Computed Gas-Phase Stability of Dicarboxylic Acid Dimers: Implications for Condensation Thermodynamics. / Elm, Jonas; Hyttinen, Noora; Lin, Jack J. et al.
    In: Journal of Physical Chemistry A, Vol. 123, No. 44, 2019, p. 9594-9599.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  56. Published
    Unexpected Growth Coordinate in Large Clusters Consisting of Sulfuric Acid and C 8 H 12 O 6 Tricarboxylic Acid. / Elm, Jonas.
    In: Journal of Physical Chemistry A, Vol. 123, No. 14, 2019, p. 3170-3175.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  57. 2018
  58. Published
    Atmospheric chemistry of iodine anions: Elementary reactions of I-, IO-, and IO2 - with ozone studied in the gas-phase at 300 K using an ion trap. / Teiwes, Ricky; Elm, Jonas; Handrup, Karsten et al.
    In: Physical Chemistry Chemical Physics, Vol. 20, No. 45, 07.12.2018, p. 28606-28615.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  59. Published
    Hydration of Atmospheric Molecular Clusters II: Organic Acid-Water Clusters. / Kildgaard, Jens Vive; Mikkelsen, Kurt V.; Bilde, Merete et al.
    In: The journal of physical chemistry. A, Vol. 122, No. 43, 01.11.2018, p. 8549-8556.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  60. Published
    Atmospheric Oxidation of Piperazine Initiated by ·cl: Unexpected High Nitrosamine Yield. / Ma, Fangfang; Ding, Zhezheng; Elm, Jonas et al.
    In: Environmental Science and Technology, Vol. 52, No. 17, 04.09.2018, p. 9801-9809.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  61. Published
    Hydration of Atmospheric Molecular Clusters: A New Method for Systematic Configurational Sampling. / Kildgaard, Jens Vive; Mikkelsen, Kurt V.; Bilde, Merete et al.
    In: Journal of Physical Chemistry A, Vol. 122, No. 22, 07.06.2018, p. 5026-5036.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  62. Published
    New Particle Formation and Growth: Creating a New Atmospheric Phase Interface. / Olenius, Tinja; Yli-Juuti, Taina; Elm, Jonas et al.
    Physical Chemistry of Gas-Liquid Interfaces. Elsevier, 2018. p. 315-352.

    Research output: Contribution to book/anthology/report/proceeding › Book chapter › Research › peer-review

  63. Published
    Guanidine: A Highly Efficient Stabilizer in Atmospheric New-Particle Formation. / Myllys, Nanna; Ponkkonen, Tuomo; Passananti, Monica et al.
    In: Journal of Physical Chemistry A, Vol. 122, No. 20, 24.05.2018, p. 4717-4729.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  64. Published
    Closed-Shell Organic Compounds Might Form Dimers at the Surface of Molecular Clusters. / Hirvonen, Viivi; Myllys, Nanna; Kurtén, Theo et al.
    In: Journal of Physical Chemistry A, Vol. 122, No. 6, 15.02.2018, p. 1771-1780.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  65. 2017
  66. Published
    Elucidating the Limiting Steps in Sulfuric Acid-Base New Particle Formation. / Elm, Jonas.
    In: Journal of Physical Chemistry A, Vol. 121, No. 43, 02.11.2017, p. 8288-8295.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  67. Published
    Can COSMOTherm Predict a Salting in Effect? / Toivola, Martta; Prisle, Nonne L.; Elm, Jonas et al.
    In: Journal of Physical Chemistry A, Vol. 121, No. 33, 24.08.2017, p. 6288-6295.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  68. Published
    Diamines Can Initiate New Particle Formation in the Atmosphere. / Elm, Jonas; Passananti, Monica; Kurtén, Theo et al.
    In: Journal of Physical Chemistry A, Vol. 121, No. 32, 17.08.2017, p. 6155-6164.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  69. Published
    Atmospheric Fate of Monoethanolamine: Enhancing New Particle Formation of Sulfuric Acid as an Important Removal Process. / Xie, Hong-Bin; Elm, Jonas; Halonen, Roope et al.
    In: Environmental Science & Technology, Vol. 51, No. 15, 01.08.2017, p. 8422-8431.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  70. Published
    Effect of Bisulfate, Ammonia, and Ammonium on the Clustering of Organic Acids and Sulfuric Acid. / Myllys, Nanna; Olenius, Tinja; Kurten, Theo et al.
    In: Journal of Physical Chemistry A, Vol. 121, No. 25, 29.06.2017, p. 4812-4824.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  71. Published
    What Is Required for Highly Oxidized Molecules To Form Clusters with Sulfuric Acid? / Elm, Jonas; Myllys, Nanna; Kurten, Theo.
    In: Journal of Physical Chemistry A, Vol. 121, No. 23, 15.06.2017, p. 4578-4587.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  72. Published
    Towards Storage of Solar Energy in Photochromic Molecules: Benzannulation of the Dihydroazulene/ Vinylheptafulvene Couple. / Skov, Anders B.; Petersen, Johannes F.; Elm, Jonas et al.
    In: ChemPhotoChem, Vol. 1, No. 5, 05.2017, p. 206-212.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  73. Published
    Benchmark Study of the Structural and Thermochemical Properties of a Dihydroazulene/Vinylheptafulvene Photoswitch. / Koerstz, Mads; Elm, Jonas; Mikkelsen, Kurt V.
    In: Journal of Physical Chemistry A, Vol. 121, No. 16, 27.04.2017, p. 3148-3154.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  74. Published
    Formation of atmospheric molecular clusters consisting of sulfuric acid and C8H12O6 tricarboxylic acid. / Elm, Jonas; Myllys, Nanna; Olenius, Tinja et al.
    In: Physical Chemistry Chemical Physics, Vol. 19, No. 6, 14.02.2017, p. 4877-4886.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  75. Published
    Phosphoric acid - a potentially elusive participant in atmospheric new particle formation. / Elm, Jonas; Myllys, Nanna; Kurten, Theo.
    In: Molecular Physics, Vol. 115, No. 17-18, 2017, p. 2168-2179.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  76. 2016
  77. Published
    Density functional theory basis set convergence of sulfuric acid-containing molecular clusters. / Myllys, Nanna; Elm, Jonas; Kurten, Theo.
    In: Computational and Theoretical Chemistry, Vol. 1098, 15.12.2016, p. 1-12.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  78. Published
    Theoretical Investigation of Substituent Effects on the Dihydroazulene/Vinylheptafulvene Photoswitch: Increasing the Energy Storage Capacity. / Hansen, Mia Harring; Elm, Jonas; Olsen, Stine T. et al.
    In: Journal of Physical Chemistry A, Vol. 120, No. 49, 15.12.2016, p. 9782-9793.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  79. Published
    Effect of Conformers on Free Energies of Atmospheric Complexes. / Partanen, Lauri; Vehkamaki, Hanna; Hansen, Klavs et al.
    In: Journal of Physical Chemistry A, Vol. 120, No. 43, 03.11.2016, p. 8613-8624.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  80. Published
    Aromaticity-Controlled Energy Storage Capacity of the Dihydroazulene-Vinylheptafulvene Photochromic System. / Skov, Anders B.; Broman, Soren Lindbaek; Gertsen, Anders S. et al.
    In: Chemistry: A European Journal, Vol. 22, No. 41, 10.2016, p. 14567-14575.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  81. Published
    Strong Hydrogen Bonded Molecular Interactions between Atmospheric Diamines and Sulfuric Acid. / Elm, Jonas; Jen, Coty N.; Kurten, Theo et al.
    In: Journal of Physical Chemistry A, Vol. 120, No. 20, 26.05.2016, p. 3693-3700.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  82. Published
    The Effect of Water and Bases on the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Sulfuric Acid. / Elm, Jonas; Myllys, Nanna; Luy, Jan-Niclas et al.
    In: Journal of Physical Chemistry A, Vol. 120, No. 14, 14.04.2016, p. 2240-2249.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  83. Published
    Coupled Cluster Evaluation of the Stability of Atmospheric Acid-Base Clusters with up to 10 Molecules. / Myllys, Nanna; Elm, Jonas; Halonen, Roope et al.
    In: Journal of Physical Chemistry A, Vol. 120, No. 4, 04.02.2016, p. 621-630.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  84. Published
    Azulenium chemistry: towards new derivatives of photochromic dihydroazulenes. / Petersen, Anne Ugleholdt; Jevric, Martyn; Elm, Jonas et al.
    In: Organic & Biomolecular Chemistry, Vol. 14, No. 8, 2016, p. 2403-2412.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  85. Published
    Fine-tuning the lifetimes and energy storage capacities of meta-stable vinylheptafulvenes via substitution at the vinyl position. / Cacciarini, Martina; Jevric, Martyn; Elm, Jonas et al.
    In: RSC Advances, Vol. 6, No. 54, 2016, p. 49003-49010.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  86. 2015
  87. Published
    Glyoxal and Methylglyoxal Setschenow Salting Constants in Sulfate, Nitrate, and Chloride Solutions: Measurements and Gibbs Energies. / Waxman, Eleanor M.; Elm, Jonas; Kurten, Theo et al.
    In: Environmental Science & Technology, Vol. 49, No. 19, 06.10.2015, p. 11500-11508.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  88. Published
    Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid. / Elm, Jonas; Myllys, Nanna; Hyttinen, Noora et al.
    In: Journal of Physical Chemistry A, Vol. 119, No. 30, 30.07.2015, p. 8414-8421.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  89. Published
    Computational Study of the Effect of Glyoxal-Sulfate Clustering on the Henry's Law Coefficient of Glyoxal. / Kurten, Theo; Elm, Jonas; Prisle, Nonne L. et al.
    In: Journal of Physical Chemistry A, Vol. 119, No. 19, 14.05.2015, p. 4509-4514.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  90. Published
    Towards Solar Energy Storage in the Photochromic Dihydroazulene-Vinylheptafulvene System. / Cacciarini, Martina; Skov, Anders B.; Jevric, Martyn et al.
    In: Chemistry: A European Journal, Vol. 21, No. 20, 11.05.2015, p. 7454-7461.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  91. Published
    Computational Methodology Study of the Optical and Thermochemical Properties of a Molecular Photoswitch. / Olsen, Stine T.; Elm, Jonas; Storm, Freja Eilso et al.
    In: Journal of Physical Chemistry A, Vol. 119, No. 5, 05.02.2015, p. 896-904.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  92. Published
    Rayleigh light scattering properties of atmospheric molecular clusters consisting of sulfuric acid and bases. / Elm, Jonas; Norman, Patrick; Mikkelsen, Kurt V.
    In: Physical Chemistry Chemical Physics, Vol. 17, No. 24, 2015, p. 15701-15709.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  93. 2014
  94. Published
    Computational approaches for efficiently modelling of small atmospheric clusters. / Elm, Jonas; Mikkelsen, Kurt V.
    In: Chemical Physics Letters, Vol. 615, 05.11.2014, p. 26-29.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  95. Published
    Methane sulfonic acid-enhanced formation of molecular clusters of sulfuric acid and dimethyl amine. / Bork, N.; Elm, J.; Olenius, T. et al.
    In: Atmospheric Chemistry and Physics, Vol. 14, No. 22, 2014, p. 12023-12030.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  96. 2012
  97. Published
    Obtaining Enhanced Circular Dichroism in [4]Heterohelicenium Analogues. / Elm, Jonas; Lykkebo, Jacob; Sorensen, Thomas J. et al.
    In: Journal of Physical Chemistry A, Vol. 116, No. 34, 30.08.2012, p. 8744-8752.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  98. Published
    Assessment of Density Functional Theory in Predicting Structures and Free Energies of Reaction of Atmospheric Prenucleation Clusters. / Elm, Jonas; Bilde, Merete; Mikkelsen, Kurt V.
    In: Journal of Chemical Theory and Computation, Vol. 8, No. 6, 06.2012, p. 2071-2077.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  99. Published
    Large area, soft crystalline thin films of N,N ',N ''-trialkyltriazatriangulenium salts with homeotropic alignment of the discotic cores in a lamellar lattice. / Sorensen, Thomas Just; Hildebrandt, Christoffer B.; Elm, Jonas et al.
    In: Journal of Materials Chemistry, Vol. 22, No. 11, 2012, p. 4797-4805.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  100. 2011
  101. Published
    Racemization Mechanisms and Electronic Circular Dichroism of [4]Heterohelicenium Dyes: A Theoretical Study. / Elm, Jonas; Lykkebo, Jacob; Sorensen, Thomas J. et al.
    In: Journal of Physical Chemistry A, Vol. 115, No. 43, 03.11.2011, p. 12025-12033.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review

  102. Published
    Direct probing of ion pair formation using a symmetric triangulenium dye. / Westerlund, Fredrik; Elm, Jonas; Lykkebo, Jacob et al.
    In: Photochemical & Photobiological Sciences, Vol. 10, No. 12, 2011, p. 1963-1973.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaper › Journal article › Research › peer-review