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2022
Mark A modified Jarzynski free-energy estimator to eliminate non-conservative forces and its application in nanoparticle-membrane interactions
Hosseini, Atiyeh Najla ; Lund, Mikael ^LU and Ejtehadi, Mohammad Reza (2022) In Physical Chemistry Chemical Physics 24(6). p.3647-3654
- Contribution to journal › Article
Mark Anion-cation contrast of small molecule solvation in salt solutions
Hervø-Hansen, Stefan ^LU ; Heyda, Jan ; Lund, Mikael ^LU and Matubayasi, Nobuyuki (2022) In Physical Chemistry Chemical Physics 24(5). p.3238-3249
- Contribution to journal › Article
Mark The cobalt oxidation state in preferential CO oxidation on CoO_x/Pt(111) investigated by operando X-ray photoemission spectroscopy
Rattigan, Eoghan ; Sun, Zhaozong ; Gallo, Tamires ^LU ; Nino, Miguel Angel ; Parreiras, Sofia de Oliveira ; Martín-Fuentes, Cristina ; Martin-Romano, Juan Carlos ; Écija, David ; Escudero, Carlos and Villar, Ignacio , et al. (2022) In Physical Chemistry Chemical Physics 24(16). p.9236-9246
- Contribution to journal › Article
Mark Probing aqueous ions with non-local Auger relaxation
Gopakumar, Geethanjali ; Muchová, Eva ; Unger, Isaak ; Malerz, Sebastian ; Trinter, Florian ; Öhrwall, Gunnar ^LU ; Lipparini, Filippo ; Mennucci, Benedetta ; Céolin, Denis and Caleman, Carl , et al. (2022) In Physical Chemistry Chemical Physics 24(15). p.8661-8671
- Contribution to journal › Article
Mark Revealing the sensing mechanism of a fluorescent pH probe based on a bichromophore approach
Zhang, Wei ^LU ; Zhao, Li ; Laursen, Bo W. and Chen, Junsheng ^LU (2022) In Physical Chemistry Chemical Physics 24(43). p.26731-26737
- Contribution to journal › Article
Mark Core-shell excitation of isoxazole at the C, N, and O K-edges - an experimental NEXAFS and theoretical TD-DFT study
Wasowicz, T. J. ; Ljubić, I. ; Kivimäki, A. ^LU and Richter, R. (2022) In Physical Chemistry Chemical Physics 24(32). p.19302-19313
- Contribution to journal › Article
Mark An atomistic explanation of the ethanol-water azeotrope
Carravetta, Vincenzo ; Gomes, Anderson Herbert de Abreu ; Marinho, Ricardo dos Reis Teixeira ; Öhrwall, Gunnar ^LU ; Ågren, Hans ; Björneholm, Olle ^LU and de Brito, Arnaldo Naves (2022) In Physical Chemistry Chemical Physics 24(42). p.26037-26045
- Contribution to journal › Article
Mark Electronic polarization effects on membrane translocation of anti-cancer drugs
Najla Hosseini, Atiyeh ; Lund, Mikael ^LU and Ejtehadi, Mohammad Reza (2022) In Physical Chemistry Chemical Physics 24(20). p.12281-12292
- Contribution to journal › Article
Mark Electron transport via tyrosine-doped oligo-alanine peptide junctions : role of charges and hydrogen bonding
Guo, Cunlan ; Gavrilov, Yulian ^LU ; Gupta, Satyajit ; Bendikov, Tatyana ; Levy, Yaakov ; Vilan, Ayelet ; Pecht, Israel ; Sheves, Mordechai and Cahen, David (2022) In Physical Chemistry Chemical Physics 24(47). p.28878-28885
- Contribution to journal › Article
Mark Soft X-ray signatures of cationic manganese-oxo systems, including a high-spin manganese(v) complex
Delcey, Mickaël G. ^LU ; Lindblad, Rebecka ^LU ; Timm, Martin ; Bülow, Christine ; Zamudio-Bayer, Vicente ; Von Issendorff, Bernd ; Lau, J. Tobias and Lundberg, Marcus (2022) In Physical Chemistry Chemical Physics 24(6). p.3598-3610
- Contribution to journal › Article

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