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研究领域

Research at the laboratory of crystallography aims at establishing relationships between crystal structure and physical properties, as well as at providing the structural basics for the understanding of phase transitions. The Research is concentrated on aperiodic crystals, including phase transitions between incommensurate, periodic and partially ordered structures. The second topic of interest is accurate charge-density studies by the Maximum Entropy Method for both periodic and aperiodic crystals. Experimental methods at the Laboratory of Crystallography include single-crystal x-ray diffraction and x-ray powder diffraction (Equipment). Both techniques can be combined with low- and high temperature attachments and they can be performed at high pressures. X-ray scattering is also performed with synchrotron radiation at Hasylab (Hamburg), ESRF (Grenoble), and NSLS (Brookhaven - USA). A selection of specific projects Maximum Entropy Method (MEM) Low-dimensional magnetic materials Charge-density-wave compounds Materials physics

近期论文

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Toms Rekis, Achim M. Schaller, Surya Rohith Kotla, Andreas Schönleber, Leila Noohinejad, Martin Tolkiehn, Carsten Paulmann, Sander van Smaalen: Single-crystal-to-single-crystal phase transitions of commensurately modulated sodium saccharinate 1.875-hydrate. In: IUCrJ, 8 (2021). - S. 139-147. doi:10.1107/S2052252520015912 Natalija van Well, Sitaram Ramakrishnan, Ketty Beauvois, Navid Qureshi, Eric Ressouche, Markos Skoulatos, Robert Georgii, Oksana Zaharko, Sander van Smaalen: Magnetic‐Field‐Controlled Quantum Critical Points in the Triangular Antiferromagnetic Cs2CuCl4‐xBrx Mixed System. In: Annalen der Physik, 532 (2020). - S. No. 2000147. doi:10.1002/andp.202000147 Barbora Vénosová, Julia Koziskova, Jozef Kožíšek, Peter Herich, Karol Lušpai, Vaclav Petricek, Jens Hartung, Mike Müller, Christian B. Hübschle, Sander van Smaalen, Lukas Bucinsky: Charge density of 4-methyl-3-[(tetra­hydro-2H-pyran-2-yl)­­oxy]thia­zole-2(3H)-thione : A comprehensive multipole refinement, maximum entropy method and density functional theory study. In: Acta Crystallographica Section B, 76 (2020). - S. 450-468. doi:10.1107/S2052520620005533 Zhengqiang Yang, Alan J. Drew, Sander van Smaalen, Natalija van Well, Francis L. Pratt, Gavin B. G. Stenning, Abid Karim, Kaneez Rabia: Multiple magnetic-phase transitions and critical behavior of charge-density wave compound TbTe3. In: Journal of Physics: Condensed Matter, 32 (2020). - S. No. 305801. doi:10.1088/1361-648x/ab8425 Natalija van Well, Michael Bolte, Claudio Eisele, Lukas Keller, Jürg Schefer, Sander van Smaalen: Mixed system Cs3Cu3Cl8-xBrxOH with weakly connected Cu-triangles. In: Journal of Physics and Chemistry of Solids, 140 (2020). - S. No. 109386. doi:10.1016/j.jpcs.2020.109386 Sitaram Ramakrishnan, Andreas Schönleber, Toms Rekis, Natalija van Well, Leila Noohinejad, Sander van Smaalen, Martin Tolkiehn, Carsten Paulmann, Biplab Bag, Arumugam Thamizhavel, Dilip Pal, Srinivasan Ramakrishnan: Unusual charge density wave transition and absence of magnetic ordering in \mathrmEr₂\mathrmIr₃\mathrmSi₅. In: Physical Review B, 101 (2020). - S. No. 060101. doi:10.1103/PhysRevB.101.060101 Mengxia Wang, Jian Zhang, Zhengping Wang, Ci Wang, Sander van Smaalen, Hang Xiao, Xi Chen, Chenlin Du, Xinguang Xu, Xutang Tao: Broadband CrOCl Saturable Absorber with a Spectral Region Extension to 10.6 µm. In: Advanced Optical Materials, 8 (2020). - S. No. 1901446. doi:10.1002/adom.201901446 Toms Rekis, Andreas Schönleber, Sander van Smaalen: On the puzzling case of sodium saccharinate 1.875-hydrate : structure description in (3+1)-dimensional superspace. In: Acta Crystallographica Section B, 76 (2020). - S. 18-27. doi:10.1107/S2052520619014938 Johannes Welsch, Sitaram Ramakrishnan, Claudio Eisele, Natalija van Well, Andreas Schönleber, Sander van Smaalen, Shidaling Matteppanavar, Arumugam Thamizhavel, Martin Tolkiehn, Carsten Paulmann, Srinivasan Ramakrishnan: Second-order charge-density-wave transition in single crystals of \mathrmLa₃\mathrmCo₄\mathrmSn₁₃. In: Physical Review Materials, 3 (2019). - S. No. 125003. doi:10.1103/PhysRevMaterials.3.125003 Natalija van Well, Claudio Eisele, Sitaram Ramakrishnan, Tian Shang, Marisa Medarde, Antonio Cervellino, Markos Skoulatos, Robert Georgii, Sander van Smaalen: Tetragonal Mixed System Cs2CuCl4–xBrx Complemented by the Tetragonal Phase Realization of Cs2CuCl4. In: Crystal Growth & Design, 19 (2019). - S. 6627-6635. doi:10.1021/acs.cgd.9b01035 H. Johan M. Jönsson, Marcus Ekholm, Maxim Bykov, Leonid Dubrovinsky, Sander van Smaalen, Igor A. Abrikosov: Inverse pressure-induced Mott transition in \mathrmTiPO₄. In: Physical Review B, 99 (2019). - S. No. 245132. doi:10.1103/PhysRevB.99.245132 Marcus Ekholm, Andreas Schönleber, Sander van Smaalen: The role of magnetic order in VOCl. In: Journal of Physics: Condensed Matter, 31 (2019). - S. No. 325502. doi:10.1088/1361-648x/ab1eff Sitaram Ramakrishnan, Andreas Schönleber, Christian B. Hübschle, Claudio Eisele, Achim M. Schaller, Toms Rekis, Nguyen Hai An Bui, Florian Feulner, Sander van Smaalen, Biplab Bag, Srinivasan Ramakrishnan, Martin Tolkiehn, Carsten Paulmann: Charge density wave and lock-in transitions of \mathrmCuV₂\mathrmS₄. In: Physical Review B, 99 (2019). - S. No. 195140. doi:10.1103/PhysRevB.99.195140 Ines E. Collings, Denis M. Vasiukov, Catherine McCammon, Leonid Dubrovinsky, Valerio Cerantola, Sylvain Petitgirard, Christian B. Hübschle, Andreas Schönleber, Dmitry Chernyshov, Sander van Smaalen, Natalia Dubrovinskaia: Local Structure of Ferroic Iron Formates at Low Temperature and High Pressure Studied by Mössbauer Spectroscopy. In: The Journal of Physical Chemistry C, 123 (2019). - S. 21676-21684. doi:10.1021/acs.jpcc.9b04749 H. Johan M. Jönsson, Marcus Ekholm, Maxim Bykov, Leonid Dubrovinsky, Sander van Smaalen, Igor A. Abrikosov: Inverse pressure-induced Mott transition in TiPO₄. In: Physical Review B, 99 (2019). - . doi:10.1103/PhysRevB.99.245132 Shidaling Matteppanavar, Nguyen Hai An Bui, Sander van Smaalen, Arumugam Thamizhavel, Srinivasan Ramakrishnan: An unusual metallic behavior in a Ag4SSe single crystal. In: DAE Solid State Physics Symposium 2017. - Melville Park, NY : AIP Publishing, 2018. - S. 130001. doi:10.1063/1.5029071 Somnath Dey, Andreas Schönleber, Swastik Mondal, Sk Imran Ali, Sander van Smaalen: Role of Steric Hindrance in the Crystal Packing of Z' = 4 Superstructure of Trimethyltin Hydroxide. In: Crystal Growth & Design, 18 (2018). - S. 1394-1400. doi:10.1021/acs.cgd.7b01295 Mohamed E. M. Abdelbagi, Wolfgang Milius, Swastik Mondal, Sander van Smaalen, Helmut G. Alt: 1,2-Bis(dimethylsilyl)phenylidene bridged zirconocene and hafnocene dichloride complexes as precatalysts for ethylene polymerization. In: Journal of Organometallic Chemistry, 854 (2018). - S. 76-86. doi:10.1016/j.jorganchem.2017.11.010 Shidaling Matteppanavar, Nguyen Hai An Bui, Srinivasan Ramakrishnan, Megha Vagadia, Arumugam Thamizhavel, Arpita Paul, Umesh V. Waghmare, Andreas Schönleber, Sander van Smaalen: Unusual electronic properties of a low-temperature phase of Ag₄SSe. In: Physical Review Materials, 2 (2018). - . doi:10.1103/PhysRevMaterials.2.113606 Tanaji P. Gujar, Thomas Unger, Andreas Schönleber, Martina Fried, Fabian Panzer, Sander van Smaalen, Anna Köhler, Mukundan Thelakkat: The role of PbI2 in CH3NH3PbI3 perovskite stability, solar cell parameters and device degradation. In: Physical Chemistry Chemical Physics, 20 (2018). - S. 605-614. doi:10.1039/C7CP04749E

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