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Anharmonic effects on the dynamics of solid aluminium from <em>ab initio</em> simulations
Adams, D. J., Wang, L., Steinle-Neumann, G., Passerone, D., & Churakov, S. V. (2021). Anharmonic effects on the dynamics of solid aluminium from ab initio simulations. Journal of Physics: Condensed Matter, 33(17), 175501 (8 pp.). https://doi.org/10.1088/1361-648X/abc972
Chemical gradients in automotive Cu-SSZ-13 catalysts for NO<sub><em>x</em></sub> removal revealed by operando X-ray spectrotomography
Becher, J., Ferreira Sanchez, D., Doronkin, D. E., Zengel, D., Motta Meira, D., Pascarelli, S., … Sheppard, T. L. (2021). Chemical gradients in automotive Cu-SSZ-13 catalysts for NOx removal revealed by operando X-ray spectrotomography. Nature Catalysis, 4, 46-53. https://doi.org/10.1038/s41929-020-00552-3
Tethered agonist exposure in intact adhesion/class B2 GPCRs through intrinsic structural flexibility of the GAIN domain
Beliu, G., Altrichter, S., Guixà-González, R., Hemberger, M., Brauer, I., Dahse, A. K., … Langenhan, T. (2021). Tethered agonist exposure in intact adhesion/class B2 GPCRs through intrinsic structural flexibility of the GAIN domain. Molecular Cell, 81(5), 905-921.e5. https://doi.org/10.1016/j.molcel.2020.12.042
Band gap narrowing in silane-grafted ZnO nanocrystals. A comprehensive study by wide-angle X-ray total scattering methods
Bertolotti, F., Tǎbǎcaru, A., Muşat, V., Ţigǎu, N., Cervellino, A., Masciocchi, N., & Guagliardi, A. (2021). Band gap narrowing in silane-grafted ZnO nanocrystals. A comprehensive study by wide-angle X-ray total scattering methods. Journal of Physical Chemistry C, 125(8), 4806-4819. https://doi.org/10.1021/acs.jpcc.0c10502
Biogenic particles formed in the Himalaya as an important source of free tropospheric aerosols
Bianchi, F., Junninen, H., Bigi, A., Sinclair, V. A., Dada, L., Hoyle, C. R., … Dommen, J. (2021). Biogenic particles formed in the Himalaya as an important source of free tropospheric aerosols. Nature Geoscience, 14, 4-9. https://doi.org/10.1038/s41561-020-00661-5
Comparison of weekly and daily online adaptation for head and neck intensity-modulated proton therapy
Bobić, M., Lalonde, A., Sharp, G. C., Grassberger, C., Verburg, J. M., Winey, B. A., … Paganetti, H. (2021). Comparison of weekly and daily online adaptation for head and neck intensity-modulated proton therapy. Physics in Medicine and Biology, 66(5), 055023 (11 pp.). https://doi.org/10.1088/1361-6560/abe050
From energetics to intracluster chemistry: valence photoionization of trifluoromethylsulfur pentafluoride (CF<sub>3</sub>SF<sub>5</sub>) by double velocity map imaging
Bodi, A., Hemberger, P., & Tuckett, R. P. (2021). From energetics to intracluster chemistry: valence photoionization of trifluoromethylsulfur pentafluoride (CF3SF5) by double velocity map imaging. Journal of Physical Chemistry A, 125(12), 2601-2611. https://doi.org/10.1021/acs.jpca.1c00918
An experimental and numerical investigation of the catalytic-rich/gaseous-lean combustion of H<sub>2</sub>/CO/air mixtures at 8 bar
Bolaños-Chaverri, F., Mantzaras, J., Griffin, T., Bombach, R., & Winkler, D. (2021). An experimental and numerical investigation of the catalytic-rich/gaseous-lean combustion of H2/CO/air mixtures at 8 bar. Proceedings of the Combustion Institute, 38(4), 5443-5451. https://doi.org/10.1016/j.proci.2020.06.149
Five birds with one stone: photoelectron photoion coincidence unveils rich phthalide pyrolysis chemistry
Bouwman, J., Hrodmarsson, H. R., Ellison, G. B., Bodi, A., & Hemberger, P. (2021). Five birds with one stone: photoelectron photoion coincidence unveils rich phthalide pyrolysis chemistry. Journal of Physical Chemistry A, 125(8), 1738-1746. https://doi.org/10.1021/acs.jpca.1c00149
Real-time organic aerosol chemical speciation in the indoor environment using extractive electrospray ionization mass spectrometry
Brown, W. L., Day, D. A., Stark, H., Pagonis, D., Krechmer, J. E., Liu, X., … Jimenez, J. L. (2021). Real-time organic aerosol chemical speciation in the indoor environment using extractive electrospray ionization mass spectrometry. Indoor Air, 31(1), 141-155. https://doi.org/10.1111/ina.12721
On the modelling of the transition between contact-line and microlayer evaporation regimes in nucleate boiling
Bureš, L., & Sato, Y. (2021). On the modelling of the transition between contact-line and microlayer evaporation regimes in nucleate boiling. Journal of Fluid Mechanics, 916(53), A53 (23 pp.). https://doi.org/10.1017/jfm.2021.204
Cd&lt;sup&gt;2+&lt;/sup&gt; incorporation in small-pore LEV/ERI intergrown zeolites: a multi-methodological study
Cametti, G., Scheinost, A. C., & Churakov, S. V. (2021). Cd2+ incorporation in small-pore LEV/ERI intergrown zeolites: a multi-methodological study. Microporous and Mesoporous Materials, 313, 110835 (11 pp.). https://doi.org/10.1016/j.micromeso.2020.110835
A photogrammetric method for target monitoring inside the MEG II detector
Cavoto, G., Chiarello, G., Hildebrandt, M., Hofer, A., Ieki, K., Meucci, M., … Voena, C. (2021). A photogrammetric method for target monitoring inside the MEG II detector. Review of Scientific Instruments, 92(4), 043707 (10 pp.). https://doi.org/10.1063/5.0034842
Mineral inclusions are not immutable: evidence of post-entrapment thermally-induced shape change of quartz in garnet
Cesare, B., Parisatto, M., Mancini, L., Peruzzo, L., Franceschi, M., Tacchetto, T., … Marone, F. (2021). Mineral inclusions are not immutable: evidence of post-entrapment thermally-induced shape change of quartz in garnet. Earth and Planetary Sciences Letters, 555, 116708 (11 pp.). https://doi.org/10.1016/j.epsl.2020.116708
High-Level Production of Phenylacetaldehyde using Fusion-Tagged Styrene Oxide Isomerase
Choo, J. P. S., Kammerer, R. A., Li, X., & Li, Z. (2021). High-Level Production of Phenylacetaldehyde using Fusion-Tagged Styrene Oxide Isomerase. Advanced Synthesis and Catalysis, 363(6), 1714-1721. https://doi.org/10.1002/adsc.202001500
To roam or not to roam, that is the question for the methyl group in isopropanol cations
Covert, K. J., Bodi, A., Torma, K. G., Voronova, K., Baer, T., & Sztáray, B. (2021). To roam or not to roam, that is the question for the methyl group in isopropanol cations. International Journal of Mass Spectrometry, 459, 116469 (7 pp.). https://doi.org/10.1016/j.ijms.2020.116469
Gas diffusion layers with deterministic structure for high performance polymer electrolyte fuel cells
Csoklich, C., Steim, R., Marone, F., Schmidt, T. J., & Büchi, F. N. (2021). Gas diffusion layers with deterministic structure for high performance polymer electrolyte fuel cells. ACS Applied Materials and Interfaces, 13(8), 9908-9918. https://doi.org/10.1021/acsami.0c20896
Clinical practice vs. state-of-the-art research and future visions: report on the 4D treatment planning workshop for particle therapy - edition 2018 and 2019
Czerska, K., Emert, F., Kopec, R., Langen, K., McClelland, J. R., Meijers, A., … Rucinski, A. (2021). Clinical practice vs. state-of-the-art research and future visions: report on the 4D treatment planning workshop for particle therapy - edition 2018 and 2019. Physica Medica, 82, 54-63. https://doi.org/10.1016/j.ejmp.2020.12.013
Fast full-field modulation transfer function analysis for photographic lens quality assessment
Delley, B., & van den Bergh, F. (2021). Fast full-field modulation transfer function analysis for photographic lens quality assessment. Applied Optics, 60(8), 2197-2206. https://doi.org/10.1364/AO.415974
Optimization of multi-group energy structures for diffusion analyses of sodium-cooled fast reactors assisted by simulated annealing - part I: methodology demonstration
Di Nora, V. A., Fridman, E., Nikitin, E., Bilodid, Y., & Mikityuk, K. (2021). Optimization of multi-group energy structures for diffusion analyses of sodium-cooled fast reactors assisted by simulated annealing - part I: methodology demonstration. Annals of Nuclear Energy, 155, 108183 (9 pp.). https://doi.org/10.1016/j.anucene.2021.108183
 

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