Lab Key visual

Welcome to the “Laboratory of Molecular Simulation” , situated in the “Green Chemistry Wallis Campus”, Sion, building Industrie17.   The Laboratory is  directed by Prof. Berend Smit.



G. Bauer; D. Ongari; X. Xu; D. Tiana; B. Smit et al. : Metal-Organic Frameworks Invert Molecular Reactivity: Lewis Acidic Phosphonium Zwitterions Catalyze the Aldol-Tishchenko Reaction; Journal Of The American Chemical Society. 2017. DOI : 10.1021/jacs.7b10928.
D. Ongari; P. G. Boyd; S. Barthel; M. Witman; M. Haranczyk et al. : Accurate Characterization of the Pore Volume in Microporous Crystalline Materials; Langmuir. 2017. DOI : 10.1021/acs.langmuir.7b01682.
A. Gladysiak; T. N. Nguyen; J. A. R. Navarro; M. J. Rosseinsky; K. C. Stylianou : A Recyclable Metal-Organic Framework as a Dual Detector and Adsorbent for Ammonia; Chemistry-A European Journal. 2017. DOI : 10.1002/chem.201703510.
S. L. Anderson; K. C. Stylianou : Biologically derived metal organic frameworks; Coordination Chemistry Reviews. 2017. DOI : 10.1016/j.ccr.2017.07.012.
J. Xu; E. S. M. Blaakrneer; A. S. Lipton; T. M. Mcdonald; Y. M. Liu et al. : Uncovering the Local Magnesium Environment in the Metal-Organic Framework Mg-2(dobpdc) Using Mg-25 NMR Spectroscopy; Journal Of Physical Chemistry C. 2017. DOI : 10.1021/acs.jpcc.7b07809.