| Title | Authors / Editors | Date |
unige:162239 |
Large resistivity reduction in mixed-valent CsAuBr3 under pressure |
Naumov, Pavel; Huangfu, Shangxiong; Wu, Xianxin; Schilling, Andreas; ... von Rohr, Fabian |
2019 |
unige:91450 |
Triggering Emission with the Helical Turn in Thiadiazole-Helicenes |
Biet, Thomas; Martin, Kévin; Hankache, Jihane; Hellou, Nora; ... Avarvari, Narcis |
2017 |
unige:90268 |
Physicochemical and Electronic Properties of Cationic [6]Helicenes: from Chemical and Electrochemical Stabilities to Far-Red (Polarized) Luminescence |
Bosson, Johann; Labrador Beltran, Maria Géraldine; Pascal, Simon; Miannay, François-Alexandre; ... Lacour, Jérôme |
2016 |
unige:91983 |
A Highly Effective Ruthenium System for the Catalyzed Dehydrogenative Cyclization of Amine-Boranes to Cyclic Boranes under Mild Conditions |
Wallis, Christopher J.; Alcaraz, Gilles; Petit, Alban S.; Poblador Bahamonde, Amalia Isabel; ... Sabo-Etienne, Sylviane |
2015 |
unige:41527 |
Nonuniform Continuum Model for Solvatochromism Based on Frozen-Density Embedding Theory |
Shedge, Sapana; Wesolowski, Tomasz Adam |
2014 |
unige:23743 |
A Spectroscopic and Computational Study of a Photoinduced Cross-Dehydrogenative Coupling Reaction of a Stable Semiquinone Radical |
Grilj, Jakob; Todorova, Tanya Kumanova; Yi, Chenyi; Liu, Shi-Xia; ... Decurtins, Silvio |
2012 |
unige:18373 |
Assessing Metal-Metal Multiple Bonds in Cr-Cr, Mo-Mo, and W-W Compounds and a Hypothetical U-U Compound: A Quantum Chemical Study Comparing DFT and Multireference Methods |
Li Manni, Giovanni; Dzubak, Allison L.; Mulla, Abbas; Brogden, David W.; ... Gagliardi, Laura |
2012 |
unige:14721 |
The cis-[RuII(bpy)2(H2O)2]2+ Water-Oxidation Catalyst Revisited |
Sala, Xavier; Ertem, Mehmed Z.; Vigara, Laura; Todorova, Tanya K.; ... Llobet, Antoni |
2010 |
unige:14778 |
Al3Li4(BH4)13: A Complex Double-Cation Borohydride with a New Structure |
Lindemann, Inge; Ferrer, Roger Domènech; Dunsch, Lothar; Filinchuk, Yaroslav; ... Gutfleisch, Oliver |
2010 |
unige:35919 |
Co-adsorption patterns of NH3 on Si(001): Comment on “The ordering of the adsorbed NH3 molecules across the Si dimer rows on the Si(001) surface” |
Owen, James; Bowler, D. R. |
2008 |
unige:3195 |
Ab initio static and molecular dynamics study of 4-styrylpyridine: Structure, energy and reactivity of the cis and trans isomers in the ground state |
Lawson Daku, Latevi Max; Linares, Jorge; Boillot, Marie-Laure |
2007 |
unige:14692 |
Enantiodiscrimination between an N-acetyl-L-cysteine SAM and proline: an in situ spectroscopic and computational study |
Bieri, Marco; Buergi, Thomas |
2006 |
unige:3635 |
Photoswitching of the Dielectric Constant of the Spin-Crossover Complex [Fe(L)(CN)2]H2O |
Bonhommeau, Sébastien; Guillon, Thomas; Lawson Daku, Latevi Max; Demont, Philippe; ... Bousseksou, Azzedine |
2006 |
unige:3637 |
Formation and Structure of a Stable Monoradical Cation by Reduction of a Diphosphafulvenium Salt |
Biaso, Frédéric; Cantat, Thibault; Mézailles, Nicolas; Ricard, Louis; ... Geoffroy, Michel |
2006 |
unige:3645 |
A Quantum Chemical Study of the Quintuple Bond between Two Chromium Centers in [PhCrCrPh]: trans-Bent versus Linear Geometry |
Brynda, Marcin; Gagliardi, Laura; Widmark, Per-Olof; Power, Philip P.; Roos, Björn O. |
2006 |
unige:3284 |
Mechanism of Nitrate Reduction by Desulfovio desulfuricans Nitrate Reductase - A Theoretical Investigation |
Leopoldini, Monica; Russo, Nino; Toscano, Marirosa; Dulak, Marcin; Wesolowski, Tomasz Adam |
2006 |
unige:3297 |
Quantum Chemical Calculations Predict the Diphenyl Diuranium Compound [PhUUPh] To Have a Stable 1Ag Ground State |
La Macchia, Giovanni; Brynda, Marcin; Gagliardi, Laura |
2006 |
unige:3621 |
Assessment of Density Functionals for the High-Spin/Low-Spin Energy Difference in the Low-Spin Iron(II) Tris(2,2'-bipyridine) Complex |
Lawson Daku, Latevi Max; Vargas, Alfredo; Hauser, Andreas; Fouqueau, Antony; Casida, Mark Earl |
2005 |
unige:7762 |
Synthesis and Stereochemical Properties of Chiral Square Complexes of Iron(II) |
Bark, Thomas; von Zelewsky, Alexander; Rappoport, Dmitrij; Neuburger, Markus; ... Jodry, Jonathan |
2004 |
unige:3252 |
Effect of Conformational Changes on a One-Electron Reduction Process: Evidence of a One-Electron PP Bond Formation in a Bis(phosphinine) |
Choua, Sylvie; Dutan, Cosmina; Cataldo, Laurent; Berclaz, Théo; ... Le Floch, Pascal |
2004 |