Journal Article (205)

201.
Journal Article
Schunk, D.; Hardt, S.; Wiggers, H.; Marlow, F.: Monodisperse titania microspheres via controlled nanoparticle aggregation. PHYSICAL CHEMISTRY CHEMICAL PHYSICS 14 (20), pp. 7490 - 7496 (2012)
202.
Journal Article
Schüth, F.: Catalysis research-where does the path lead. Praxis der Naturwissenschaften, Chemie in der Schule 60, pp. 8 - 13 (2012)
203.
Journal Article
Thiessen, A.; Wettach, H.; Meerholz, K.; Neese, F.; Höger, S.; Hertel, D.: Control of electronic properties of triphenylene by substitution. Organic Electronics 13 (1), pp. 71 - 83 (2012)
204.
Journal Article
Wu, X.; Koslowski, A.; Thiel, W.: Semiempirical Quantum Chemical Calculations Accelerated on a Hybrid Multicore CPU-GPU Computing Platform. Journal of Chemical Theory and Computation 8 (7), pp. 2272 - 2281 (2012)
205.
Journal Article
Yang, L.; Liao, R.-Z.; Ding, W.-J.; Yu, J.-G.; Liu, K.; Liu, R.-Z.: Why Calcium Inhibits Magnesium-dependent Enzyme Phosphoserine Phosphatase? A Theoretical Study. Theoretical Chemistry Accounts 131 (9), 1275 (2012)

Book (1)

206.
Book
List, B. (Ed.): Asymmetric Organocatalysis 1: Lewis Base and Acid Catalysts. Georg Thieme Verlag KG, Stuttgart (2012), 954 pp.

Book Chapter (11)

207.
Book Chapter
Schüth, F.: Energy Storage Strategies. In: Chemical Energy Storage, pp. 35 - 48 (Ed. Schlögl, R.) (2012)
208.
Book Chapter
Mahlau, M.; List, B.: Asymmetric Counteranion-Directed Catalysis (ACDC). In: Asymmetric Synthesis II, pp. 79 - 85 (Eds. Christmann, M.; Bräse, S.). Wiley-VCH Verlag GmbH, Weinheim (2012)
209.
Book Chapter
Felderhoff, M.: Functional materials for hydrogen storage. In: Functional materials for sustainable energy applications, Vol. 35, pp. 217 - 243. Woodhead Publishing, Cambridge (2012)
210.
Book Chapter
List, B.; Liao, S.-H.; Shirakawa, S.; Maruoka, K.; Gong, L.; Xiao, W.-J.: The Proline-Catalyzed Mannich Reaction and the Advent of Enamine Catalysis. In: Organic Chemistry - Breakthroughs and Perspectives, pp. 367 - 384 (Eds. Ding, K.; Dai, L.-X.). Wiley-VCH Verlag & Co. KGaA, Weinheim (2012)
211.
Book Chapter
Klussmann, M.: Mechanism in Organocatalysis. In: Science of Synthesis Asymmetric Organocatalysis 2, pp. 633 - 671 (Ed. List, B.). Thieme, Stuttgart (2012)
212.
Book Chapter
Reetz, M. T.: Directed Evolution of Enzymes. In: Enzyme Catalysis in Organic Synthesis, Vol. 1-3, 3 Ed., pp. 119 - 190. Wiley-VCH, Weinheim (2012)
213.
Book Chapter
Atanasov, M.; Ganyushin, D.; Sivalingam, K.; Neese, F.: A Modern First-Principles View on Ligand Field Theory Through the Eyes of Correlated Multireference Wavefunctions. In: Structure and Bonding: Molecular Electronic Structures of Transition Metal Complexes II, Vol. 143, pp. 149 - 220 (Eds. Mingos, D. M. P.; Day, P.). Springer, Berlin, Heidelberg (2012)
214.
Book Chapter
Barbatti, M.; Ruckenbauer, M.; Szymczak, J. J.; Sellner, B.; Vazdar, M.; Antol, I.; Eckert-Maksić, M.; Lischka, H.: Model Systems for Dynamics of π-Conjugated Biomolecules in Excited States. In: Handbook of Computational Chemistry, Vol. 3, pp. 1175 - 1213 (Ed. Leszczynski, J.). Springer Science+Business Media B.V., Dordrecht (2012)
215.
Book Chapter
DeBeer, S.; van Gastel, M.; Bill, E.; Ye, S.; Petrenko, T.; Pantazis, D. A.; Neese, F.: 4.5 Challenges in Molecular Energy Research. In: Chemical Energy Storage (Ed. Schlögl, R.). Walter De Gruyter, Berlin (2012)
216.
Book Chapter
Muya, J. T.; Gopakumar, G.; Lijnen, E.; Nguyen, M. T.; Ceulemans, A.: Investigations of the Boron Buckyball B80: Bonding Analysis and Chemical Reactivity. In: Progress in Theoretical Chemistry and Physcis, Vol. 23, pp. 265 - 278 (Eds. Atanasov, M.; Daul, C.; Trigenna-Piggott, P. L. W.). Springer Science+Business Media B. V., Dordrecht, The Netherlands (2012)
217.
Book Chapter
Schmidt, W.: Synthetic Inorganic Ion Exchange. In: Ion Exchange Technology I, Vol. 1, pp. 277 - 298 (Eds. Inamuddin; Luqman, M.). Springer (2012)

Proceedings (2)

218.
Proceedings
Cis-trans photoisomerization of azobenzene upon excitation to the S1 state: an ab initio molecular dynamics and QM/MM study (Proc. SPIE, 8463). Nanoengineering: Fabrication, Properties, Optics, and Devices IX, San Diego, August 12, 2012. (2012)
219.
Proceedings
Rotation-vibration energy level cluster formation in three- and four-atomic molecules (AIP Conference Proceedings, 1504 ). International Conference of Computational Methods in Sciences and Engineering 2009: (iccmse 2009), Rhodes, Greece, September 29, 2009 - October 04, 2009. AIP Journals, Rhodes (2012), 500 pp.

Conference Paper (1)

220.
Conference Paper
Urbanczyk, R.; Peinecke, K.; Felderhoff, M.; Hauschild, K.; Peil, S.: Hydridspeicher aus Al-Legierungen zur Entkopplung von Wärme und Strom. In: Proceedings of the 19. Symposium – Nutzung Regenerativer Energiequellen und Wasserstofftechnik,, pp. 111 - 115. Proceedings of the 19. Symposium – Nutzung Regenerativer Energiequellen und Wasserstofftechnik, Stralsund, November 08, 2012 - November 11, 2012. (2012)
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