Search results for "CAH"
showing 10 items of 256 documents
Effective Cahn-Hilliard Equation for the Phase Separation of Active Brownian Particles
2014
The kinetic separation of repulsive active Brownian particles into a dense and a dilute phase is analyzed using a systematic coarse-graining strategy. We derive an effective Cahn-Hilliard equation on large length and time scales, which implies that the separation process can be mapped onto that of passive particles. A lower density threshold for clustering is found, and using our approach we demonstrate that clustering first proceeds via a hysteretic nucleation scenario and above a higher threshold changes into a spinodal-like instability. Our results are in agreement with particle-resolved computer simulations and can be verified in experiments of artificial or biological microswimmers.
Analysis of the plasmonic excitations in assemblies of three-dimensional electron clusters
2020
In the quest to built novel metamaterials with unique optical properties, three-dimensional assemblies of metal clusters and nanoparticles are gathering significant attention. Organized geometries, such as tetrahedra and icosahedra, can be built, for example, by using DNA strands or virus capsids as templates. Here we use the jellium model and time-dependent density functional theory to study the plasmonic resonances in different arrangements of eight-electron clusters from the electronic perspective. A charge transfer ratio index based on the induced transition densities is used to quantify the charge transfer nature of the excitations at different energies. We vary the size, shape, and in…
CCDC 1427507: Experimental Crystal Structure Determination
2015
Related Article: Eugenio Coronado, M. Carmen Giménez-López, Tomasz Korzeniak, Georgiy Levchenko, Francisco M. Romero, Alfredo Segura, Valentín García-Baonza, Julio C. Cezar, Frank M. F. de Groot, Alla Milner, Moshe Paz-Pasternak|2008|J.Am.Chem.Soc.|130|15519|doi:10.1021/ja8047046
CCDC 1427488: Experimental Crystal Structure Determination
2015
Related Article: Eugenio Coronado, M. Carmen Giménez-López, Tomasz Korzeniak, Georgiy Levchenko, Francisco M. Romero, Alfredo Segura, Valentín García-Baonza, Julio C. Cezar, Frank M. F. de Groot, Alla Milner, Moshe Paz-Pasternak|2008|J.Am.Chem.Soc.|130|15519|doi:10.1021/ja8047046
Synthetic and natural chromium bearing spinels: an optical spectroscopy study
2014
Four samples of synthetic chromium-bearing spinels of (Mg, Fe2+)(Cr, Fe3+)2O4 composition and four samples of natural spinels of predominantly (Mg, Fe2+)(Al, Cr)2O4 composition were studied at ambient conditions by means of optical absorption spectroscopy. Synthetic end-member MgCr2O4 spinel was also studied at pressures up to ca. 10 GPa. In both synthetic and natural samples, chromium is present predominantly as octahedral Cr3+ seen in the spectra as two broad intense absorption bands in the visible range caused by the electronic spin-allowed 4A2g → 4T2g and 4A2g → 4T1g transitions (U- and Y-band, respectively). A distinct doublet structure of the Y-band in both synthetic and natural spine…
CCDC 1439186: Experimental Crystal Structure Determination
2016
Related Article: Toni Mäkelä, Miia-Elina Minkkinen, and Kari Rissanen|2016|Inorg.Chem.|55|1339|doi:10.1021/acs.inorgchem.5b02780
CCDC 1478714: Experimental Crystal Structure Determination
2016
Related Article: Toni Mäkelä, Anniina Kiesilä, Elina Kalenius and Kari Rissanen|2016|Chem.-Eur.J.|22|14264|doi:10.1002/chem.201602362
CCDC 1439192: Experimental Crystal Structure Determination
2016
Related Article: Toni Mäkelä, Miia-Elina Minkkinen, and Kari Rissanen|2016|Inorg.Chem.|55|1339|doi:10.1021/acs.inorgchem.5b02780
CCDC 994085: Experimental Crystal Structure Determination
2015
Related Article: Christoph Reiter, Tony Fröhlich, Maen Zeino, Manfred Marschall, Hanife Bahsi, Maria Leidenberger, Oliver Friedrich, Barbara Kappes, Frank Hampel, Thomas Efferth, Svetlana B. Tsogoeva|2015|Eur.J.Med.Chem.|97|164|doi:10.1016/j.ejmech.2015.04.053
CCDC 1583208: Experimental Crystal Structure Determination
2018
Related Article: Nicolas Sok, Claire Bernhard, Pauline Désogère, Christine Goze, Yoann Rousselin, Frédéric Boschetti, Isabelle Baglin, Franck Denat|2018|Eur.J.Org.Chem.|2018|4762|doi:10.1002/ejoc.201800801