Improved Configurational Sampling Protocol for Large Atmospheric Molecular Clusters

Autor: Haide Wu, Morten Engsvang, Yosef Knattrup, Jakub Kubečka, Jonas Elm

Publikováno v: ACS Omega, Vol 8, Iss 47, Pp 45065-45077 (2023)

Externí odkaz: https://doaj.org/article/05f93945f11446fe899e2180455527b9

Modeling the Binding Free Energy of Large Atmospheric Sulfuric Acid–Ammonia Clusters

Autor: Morten Engsvang, Jonas Elm

Publikováno v: ACS Omega, Vol 7, Iss 9, Pp 8077-8083 (2022)

Externí odkaz: https://doaj.org/article/0f854d7e6ced469faf692061748070b9

Enhancement of Atmospheric Nucleation Precursors on Iodic Acid-Induced Nucleation:Predictive Model and Mechanism

Autor: Fangfang Ma, Hong-Bin Xie, Rongjie Zhang, Lihao Su, Qi Jiang, Weihao Tang, Jingwen Chen, Morten Engsvang, Jonas Elm, Xu-Cheng He

Publikováno v: Ma, F, Xie, H-B, Zhang, R, Su, L, Jiang, Q, Tang, W, Chen, J, Engsvang, M, Elm, J & He, X-C 2023, ' Enhancement of Atmospheric Nucleation Precursors on Iodic Acid-Induced Nucleation : Predictive Model and Mechanism ', Environmental Science & Technology, vol. 57, no. 17, pp. 6944-6954 . https://doi.org/10.1021/acs.est.3c01034

Iodic acid (IA) has recently been recognized as a key driver for new particle formation (NPF) in marine atmospheres. However, the knowledge of which atmospheric vapors can enhance IA-induced NPF remains limited. The unique halogen bond (XB)-forming c

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2609487231373351b5e659038a1081a3
https://pure.au.dk/portal/da/publications/enhancement-of-atmospheric-nucleation-precursors-on-iodic-acidinduced-nucleation(f90f96ad-0625-4310-b1b2-e25817e968fe).html