Zeitschriftenartikel (181)

161.
Zeitschriftenartikel
Schmidt, W.; Bussian, P.; Lindén, M.; Amenitsch, H.; Agren, P.; Tiemann, M.; Schüth, F.: Accessing Ultrashort Reaction Times in Particle Formation with SAXS Experiments: ZnS Precipitation on the Microsecond Time Scale. Journal of the American Chemical Society 132 (19), S. 6822 - 6826 (2010)
162.
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Schüth, F.: Paving the Way to New Energy Systems: The Key Role of the Chemical Sciences. ChemSusChem 3, S. 6 - 8 (2010)
163.
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Schüth, F.: Poröse Materialien im Überblick. Chemie Ingenieur Technik 82, S. 769 - 777 (2010)
164.
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Schüth, F.; Wagemann, K.: Kein Ausbau erneuerbarer Energien ohne Chemische Technik. Chemie Ingenieur Technik 82, S. 175 - 175 (2010)
165.
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Seidel, R. W.; Goddard, R.; Föcker, K.; Oppel, I. M.: Supramolecular isomerism of self-complementary zinc-5,10,15,20-tetra(4-pyridyl)porphyrin in the presence of dimethylformamide. CrystEngComm 12, S. 387 - 394 (2010)
166.
Zeitschriftenartikel
Shaik, S.; Cohen, S.; Wang, Y.; Chen, H.; Kumar, D.; Thiel, W.: P450 Enzymes: Their Structure, Reactivity, and Selectivity-Modeled by QM/MM Calculations. Chemical Reviews 110, S. 949 - 1017 (2010)
167.
Zeitschriftenartikel
Silva-Junior, M. R.; Sauer, S. P. A.; Schreiber, M.; Thiel, W.: Basis set effects on coupled cluster benchmarks of electronically excited states: CC3, CCSDR(3) and CC2. Molecular Physics 108, S. 453 - 465 (2010)
168.
Zeitschriftenartikel
Silva-Junior, M. R.; Schreiber, M.; Sauer, S. P. A.; Thiel, W.: Benchmarks of electronically excited states: Basis set effects on CASPT2 results. Journal of Chemical Physics 133, 174318 (2010)
169.
Zeitschriftenartikel
Silva-Junior, M. R.; Thiel, W.: Benchmark of Electronically Excited States for Semiempirical Methods: MNDO, AM1, PM3, OM1, OM2, OM3, INDO/S, and INDO/S2. Journal of Chemical Theory and Computation 6, S. 1546 - 1564 (2010)
170.
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Sun, Q.; Doerr, M.; Li, Z.; Smith, S. C.; Thiel, W.: QM/MM studies of structural and energetic properties of the far-red fluorescent protein HcRed. Physical Chemistry Chemical Physics 12, S. 2450 - 2458 (2010)
171.
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Tajvidi, K.; Ruppert, A.; Procelewska, J.; Kükrek, M.; Palkovits, R.: Feste Katalysatoren für die Hydrogenolyse von Cellulose. Chemie Ingenieur Technik 82, S. 1440 - 1440 (2010)
172.
Zeitschriftenartikel
Trapp, O.; Sahraoui, L.; Hofstadt, W.; Könen, W.: The Stereodynamics of 1,2-Dipropyldiaziridines. Chirality 22, S. 284 - 291 (2010)
173.
Zeitschriftenartikel
vom Stein, T.; Grande, P.; Sibilla, F.; Commandeur, U.; Fischer, R.; Leitner, W.; de Maria, P. D.: Salt-assisted organic-acid-catalyzed depolymerization of cellulose. Green Chemistry 12, S. 1844 - 1849 (2010)
174.
Zeitschriftenartikel
Weiss, V. C.; Heggen, B.; Müller-Plathe, F.: Critical Parameters and Surface Tension of the Room Temperature Ionic Liquid [bmim][PF₆]: A Corresponding-States Analysis of Experimental and New Simulation Data. Journal of Physical Chemistry C 114, S. 3599 - 3608 (2010)
175.
Zeitschriftenartikel
Wu, S.; Acevedo, J. P.; Reetz, M. T.: Induced allostery in the directed evolution of an enantioselective Baeyer-Villiger monooxygenase. Proceedings of the National Academy of Sciences of the United States of America 107, S. 2775 - 2780 (2010)
176.
Zeitschriftenartikel
Yachmenev, A.; Yurchenko, S. N.; Jensen, P.; Baum, O.; Giesen, T. F.; Thiel, W.: Theoretical rotation-torsion spectra of HSOH. Physical Chemistry Chemical Physics 12, S. 8387 - 8397 (2010)
177.
Zeitschriftenartikel
Yachmenev, A.; Yurchenko, S. N.; Paidarová, I.; Jensen, P.; Thiel, W.; Sauer, S. P. A.: Thermal averaging of the indirect nuclear spin-spin coupling constants of ammonia: The importance of the large amplitude inversion mode. Journal of Chemical Physics 132, 114305, S. 114305-1 - 114305-15 (2010)
178.
Zeitschriftenartikel
Yurchenko, S. N.; Carvajal, M.; Yachmenev, A.; Thiel, W.; Jensen, P.: A theoretical-spectroscopy, ab initio-based study of the electronic ground state of ¹²¹SbH₃. Journal of Quantitative Spectroscopy & Radiative Transfer 111, S. 2279 - 2290 (2010)
179.
Zeitschriftenartikel
Zheng, H.; Kahakeaw, D.; Acevedo, J. P.; Reetz, M. T.: Directed Evolution of Enantioconvergency: The Case of an Epoxide Hydrolase-Catalyzed Reaction of a Racemic Epoxide. ChemCatChem 2, S. 958 - 961 (2010)
180.
Zeitschriftenartikel
Zheng, H.; Reetz, M. T.: Manipulating the Stereoselectivity of Limonene Epoxide Hydrolase by Directed Evolution Based on Iterative Saturation Mutagenesis. Journal of the American Chemical Society 132, S. 15744 - 15751 (2010)
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