Geometry Dependence of Spin–Spin Couplings in Cyanamide by DFT Analysis (English)
- New search for: van Mourik, Tanja
- New search for: Dingley, Andrew J.
- New search for: van Mourik, Tanja
- New search for: Dingley, Andrew J.
In:
ChemPhysChem
;
8
, 2
;
288-296
;
2007
- Article (Journal) / Electronic Resource
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Title:Geometry Dependence of Spin–Spin Couplings in Cyanamide by DFT Analysis
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Contributors:van Mourik, Tanja ( author ) / Dingley, Andrew J. ( author )
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Published in:ChemPhysChem ; 8, 2 ; 288-296
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Publisher:
- New search for: WILEY‐VCH Verlag
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Publication date:2007-02-02
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Size:9 pages
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ISSN:
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DOI:
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Type of media:Article (Journal)
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Type of material:Electronic Resource
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Language:English
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Keywords:
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Source:
Table of contents – Volume 8, Issue 2
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 201
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Cover Picture: Magnetic Properties of a Ni2+ Kagome System (ChemPhysChem 2/2007)Behera, J. N. / Sundaresan, A. / Pati, Swapan K. / Rao, C. N. R. et al. | 2007
- 203
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Graphical Abstract: ChemPhysChem 2/2007| 2007
- 209
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Proton Transfer 200 Years after von Grotthuss: Insights from Ab Initio SimulationsMarx, Dominik et al. | 2007
- 213
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Controlling the Electrons Provides Means for Controlling ChemistryWeitzel, Karl‐Michael et al. | 2007
- 217
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Magnetic Properties of a Ni2+ Kagome SystemBehera, J. N. / Sundaresan, A. / Pati, Swapan K. / Rao, C. N. R. et al. | 2007
- 220
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Functionalized Metallic Carbon Nanotube Devices for pH SensingMaroto, Alicia / Balasubramanian, Kannan / Burghard, Marko / Kern, Klaus et al. | 2007
- 224
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Chiral Transformation of Achiral J‐aggregates of a Cyanine Dye Templated by Human Serum AlbuminZhang, Yazhou / Xiang, Junfeng / Tang, Yalin / Xu, Guangzhi / Yan, Wenpeng et al. | 2007
- 227
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Stepwise Formation of Ruthenium(II) Complexes by Direct Reaction on Organized Assemblies of Thiol‐Terpyridine Species on GoldTuccitto, Nunzio / Torrisi, Vanna / Cavazzini, Marco / Morotti, Tamara / Puntoriero, Fausto / Quici, Silvio / Campagna, Sebastiano / Licciardello, Antonino et al. | 2007
- 227
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Stepwise Formation of Ruthenium(II) Complexes by Direct Reaction on Organized Assemblies of Thiol-Terpyridine Species on GoldFNR HREF="nss"> FN ID="nss"> A Surface Study.Tuccitto, Nunzio et al. | 2007
- 231
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High Activity of Amine‐Doped H‐ZSM‐5 Zeolite in Ethene Protonation: Revealed by Embedding CalculationsZheng, Anmin / Wang, Lin / Chen, Lei / Yue, Yong / Ye, Chaohui / Lu, Xin / Deng, Feng et al. | 2007
- 235
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Oriented Growth of Single‐Crystalline Bi2S3 Nanowire ArraysXu, Ju / Petkov, Nikolay / Wu, Xueyan / Iacopino, Daniela / Quinn, Aidan J. / Redmond, Gareth / Bein, Thomas / Morris, Michael A. / Holmes, Justin D. et al. | 2007
- 241
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Microscopic Evidence of the Metalation of a Free‐Base Porphyrin Monolayer with IronBuchner, Florian / Schwald, Veronika / Comanici, Karmen / Steinrück, Hans‐Peter / Marbach, Hubertus et al. | 2007
- 245
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Molecular Aggregation within Self‐Ordered MonolayersGross , Leo / Rieder, Karl‐Heinz / Gourdon, André / Joachim, Christian / Moresco, Francesca et al. | 2007
- 250
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Controlled Metalation of Self‐Assembled Porphyrin Nanoarrays in Two DimensionsAuwärter, Willi / Weber‐Bargioni, Alexander / Brink, Susan / Riemann, Andreas / Schiffrin, Agustin / Ruben, Mario / Barth, Johannes V. et al. | 2007
- 255
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Kinetic Study on the Reaction of OH Radical with Dimethyl Sulfide in the Absence of OxygenGonzález‐García, Núria / González‐Lafont, Àngels / Lluch, José M. et al. | 2007
- 255
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Kinetic Study on the Reaction of OH Radical with Dimethyl Sulfide in the Absence of OxygenFNR HREF="nss"> FN ID="nss"> Variational Transition-State Theory Rate Constants and Mechanism.González-García, Núria et al. | 2007
- 264
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Thin Films Composed of Multiwalled Carbon Nanotubes, Gold Nanoparticles and Myoglobin for Humidity Detection at Room TemperatureQi, Zhi‐mei / Wei, Mingdeng / Honma, Itaru / Zhou, Haoshen et al. | 2007
- 270
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A Novel Methodological Approach for the Analysis of Host-Ligand InteractionsFNR HREF="nss"> FN ID="nss"> Applications to the Study of the Interactions of a Clinically Relevant Pentacyclic Acridine Derivative with Nucleic Acids.Strat, Daniela et al. | 2007
- 270
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A Novel Methodological Approach for the Analysis of Host–Ligand InteractionsStrat, Daniela / Missailidis, Sotiris / Drake, Alex F. et al. | 2007
- 279
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Quantitative CARS Spectroscopy Using the Maximum Entropy Method: The Main Lipid Phase TransitionRinia, Hilde A. / Bonn, Mischa / Müller, Michiel / Vartiainen, Erik M. et al. | 2007
- 279
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Quantitative CARS Spectroscopy Using the Maximum Entropy Method: The Main Lipid Phase TransitionFNR HREF="nss"> FN ID="nss"> CARS: Coherent Anti-Stokes Raman Scattering.Rinia, Hilde A. et al. | 2007
- 288
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Geometry Dependence of Spin–Spin Couplings in Cyanamide by DFT Analysisvan Mourik, Tanja / Dingley, Andrew J. et al. | 2007
- 297
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Direct Coupling of Bromine‐Mediated Methane Activation and Carbon‐Deposit GasificationOsterwalder, Neil / Stark, Wendelin J. et al. | 2007
- 297
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Direct Coupling of Bromine-Mediated Methane Activation and Carbon-Deposit GasificationFNR HREF="nss"> FN ID="nss"> AlBr3 Assisted Conversion of Methyl Bromide into Light Hydrocarbons.Osterwalder, Neil et al. | 2007
- 304
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Exploration of the Ca2+ Interaction Modes of the Nifedipine Calcium Channel AntagonistLiu, Huichun / Zhang, Liang / Li, Ping / Cukier, Robert I. / Bu, Yuxiang et al. | 2007
- 315
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Geometric H/D Isotope Effects and Cooperativity of the Hydrogen Bonds in PorphyceneShibl, Mohamed F. / Pietrzak, Mariusz / Limbach, Hans‐Heinrich / Kühn, Oliver et al. | 2007
- 322
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Toward Separation of Nuclear Spin Isomers with Coherent LightDeeb, Omar / Leibscher, Monika / Manz, Jörn / von Muellern, Wulf / Seideman, Tamar et al. | 2007
- 330
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Preview: ChemPhysChem 3/2007| 2007