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Hydrogen storage by physisorption on nanostructured graphite plateletsElectronic supplementary information (ESI) available: Fig. 1S: Potential energy surface of H2 parallel to benzene at the MP2 level. See http://www.rsc.org/suppdata/cp/b3/b316209e/

✍ Scribed by Heine, Thomas; Zhechkov, Lyuben; Seifert, Gotthard

Book ID
121432447
Publisher
Royal Society of Chemistry
Year
2004
Tongue
English
Weight
199 KB
Volume
6
Category
Article
ISSN
1463-9076

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📜 SIMILAR VOLUMES

High Br�nsted ?nuc values in SNAr displa
High Br�nsted ?nuc values in SNAr displacement. An indicator of the SET pathway?Electronic supplementary information (ESI) available: first-order rate constants for the reactions of NBD-Cl (Table S1) and NBD-Im+ (Table S2) with p-X-substituted anilines and figures showing the influence of the oxidation potential on the rates of reaction of NBD-Im+ with 1b?e and 1f in 70?30 (Fig. S1) and 20?80 (Fig. S2) (v/v) H2O?Me2SO. See http://www.rsc.org/suppdata/ob/b3/b301031g/
✍ Terrier, Fran�ois; Mokhtari, Malika; Goumont, R�gis; Hall�, Jean-Claude; Buncel, 📂 Article 📅 2003 🏛 Royal Society of Chemistry 🌐 English ⚖ 214 KB
Dynamic NMR properties of DOTA ligand: v
Dynamic NMR properties of DOTA ligand: variable pH and temperature 1H NMR study on [K(HxDOTA)](3?x)? speciesElectronic supplementary information (ESI) available: Figs. S1?3: 2D COSY spectrum of [K(DOTA)]3? at pH 13 and 260 K, experimental 1H-spectra and results of the model-calculations for some temperatures at pH 13, Eyring plot for determining the activation parameters of water?[K(HxDOTA)](3?x)? proton exchange at pH 3.87 and 4.31. See http://www.rsc.org/suppdata/dt/b4/b405116e/
✍ Csajb�k, �va; B�nyai, Istv�n; Br�cher, Ern? 📂 Article 📅 2004 🏛 Royal Society of Chemistry 🌐 English ⚖ 342 KB
Decay pathways of charge-separated state
Decay pathways of charge-separated states in strongly fluorescent electron donor?acceptor compoundsThis paper is dedicated to Professor Fred Lewis on the event of his 60th birthday.Electronic supplementary information (ESI) available: Fig. S1: Temperature effect on the non-radiative decay rate of compound 4 in methylcyclohexane. Fig. S2: Temperature effect on fluorescence intensities of compounds 4 and 5 in methylcyclohexane. Fig. S3. Triplet?triplet absorption spectra of benzophenone and 4 in benzene. Description of the triplet state properties of acceptor model compound 4. See http://www.rsc.org/suppdata/pp/b3/b307726h/
✍ Willemse, Robert J.; Theodori, Demy; Verhoeven, Jan W.; Brouwer, Albert M. 📂 Article 📅 2003 🏛 Royal Society of Chemistry 🌐 English ⚖ 164 KB
Oxygenate, oxyalkyl and alkoxycarbonyl t
Oxygenate, oxyalkyl and alkoxycarbonyl thermochemistry and rates for hydrogen abstraction from oxygenatesElectronic supplementary information (ESI) available: Supplementary Table A: The MP2/6-31G(d?) optimized Cartesian coordinates (in ?), the unscaled harmonic vibrational frequencies (in cm?1) and rotational CONSTS (in GHz) at the HF/6-31G(d?) level of the transition structures involved in the abstraction by H atom from the methoxy, primary and secondary alkoxy, carbonyl and hydroperoxy hydrogens. Supplementary Table B: The MP2/6-31G(d?) optimized Cartesian coordinates (in ?), the unscaled harmonic vibrational frequencies (in cm?1) and rotational constants (in GHz) at the HF/6-31G(d?) level of the transition structures involved in the abstraction by CH3 group from the methoxy, primary and secondary alkoxy, carbonyl and hydroperoxy hydrogens. Supplementary Table C: Number of minima on the one-dimensional rotational potential energy surface and the relative energies (in kcal mol?1) of minima together with the total barrier height (in kcal mol?1) for rotation around the specified bond at the HF/6-31G(d?) level. See http://www.rsc.org/suppdata/cp/b3/b307050f/
✍ Sumathi, R.; Green, Jr., William H. 📂 Article 📅 2003 🏛 Royal Society of Chemistry 🌐 English ⚖ 345 KB
Electrophilic and oxidative chemistry of
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✍ Okazaki, Takao; Laali, Kenneth K. 📂 Article 📅 2004 🏛 Royal Society of Chemistry 🌐 English ⚖ 409 KB