Volume 11; Issue 29

Physical Chemistry Chemical Physics

Volume 11; Issue 29

1

Calculation of the surface tension of cyclic and aromatic hydrocarbons from Monte Carlo simulations using an anisotropic united atom model (AUA)

Biscay, F., Ghoufi, A., Lachet, V., Malfreyt, P.

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.87 MB

english, 2009

2

Different electronic structures and spectroscopic properties of cationic [M(ppy)2(N∧N)]+ (M = Rh, Ir; N∧N = Hcmbpy, H2dcbpy), a DFT study

Li, Xiao-Na, Wu, Zhi-Jian, Zhang, Hong-Jie, Liu, Xiao-Juan, Zhou, Liang, Li, Zhe-Feng, Si, Zhen-Jun

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.52 MB

english, 2009

3

The role of lattice oxygen in the oxidative dehydrogenation of ethane on alumina-supported vanadium oxide

Dinse, Arne, Schomäcker, Reinhard, Bell, Alexis T.

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 589 KB

english, 2009

4

An inward replacement/etching route to synthesize double-walled Cu7S4 nanoboxes and their enhanced performances in ammonia gas sensing

Zhang, Weixin, Chen, Zhangxian, Yang, Zeheng

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 689 KB

english, 2009

5

Temperature and chemical environment effects on the aggregation extent of water soluble perylene dye into vinyl alcohol-containing polymers

Donati, Filippo, Pucci, Andrea, Ruggeri, Giacomo

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.11 MB

english, 2009

6

Electronic structure and circular dichroism spectroscopy of naphthalenediimide nanotubes

Bulheller, Benjamin M., Pantoş, G. Dan, Sanders, Jeremy K. M., Hirst, Jonathan D.

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.34 MB

english, 2009

7

Reversible photoisomerization of an azobenzene-functionalized self-assembled monolayer probed by sum-frequency generation vibrational spectroscopy

Wagner, Steffen, Leyssner, Felix, Kördel, Christian, Zarwell, Sebastian, Schmidt, Roland, Weinelt, Martin, Rück-Braun, Karola, Wolf, Martin, Tegeder, Petra

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.43 MB

english, 2009

8

Boron nitride nanotubes functionalized by a series of carbenes

Cao, Fenglei, Ren, Wei, Xu, Xianyan, Ji, Yue-meng, Zhao, Cunyuan

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.36 MB

english, 2009

9

Host–guest chemistry of the (N,N′-diarylacetamidine)rhodium(iii) complex in zeolite Y

Fonseca, António M., Gonçalves, Sara, Parpot, Pier, Neves, Isabel C.

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 739 KB

english, 2009

10

DFT study of adsorption of hydrogen and carbon monoxide on PtxBi1−x/Pt(111) bimetallic overlayers: correlation to surface electronic properties

Pašti, Igor, Mentus, Slavko

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.47 MB

english, 2009

11

In situ FTIR spectroelectrochemical characterization of n- and p-dopable phenyl-substituted polythiophenes

Yohannes, Teketel, Lattante, Sandro, Neugebauer, Helmut, Sariciftci, Niyazi Serdar, Andersson, Mats

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 759 KB

english, 2009

12

Contents

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 5.62 MB

english, 2009

13

The state of absorbed hydrogen in the structure of reduced copper chromite from the vibration spectra

Khassin, Alexander A., Kustova, Galina N., Jobic, Hervé, Yurieva, Tamara M., Chesalov, Yury A., Filonenko, Georgii A., Plyasova, Lyudmila M., Parmon, Valentin N.

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 722 KB

english, 2009

14

Creation of interfacial phonons by carbon nanotube–polymer coupling

Li, Ching-Chen, Lu, Chieh-Lien, Lin, Yu-Tang, Wei, Bee-Yu, Hsu, Wen-Kuang

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.39 MB

english, 2009

15

The reduction of water clusters H+(H2O)n to (OH−)(H2O)m by double electron transfer from Cs atoms

Panja, Subhais, Hvelplund, Preben, Nielsen, Steen Brøndsted, Uggerud, Einar

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 664 KB

english, 2009

16

Photolysis of CH3C(O)CH3 at 248 and 266 nm: pressure and temperature dependent overall quantum yields

Khamaganov, V. G., Karunanandan, R., Horowitz, A., Dillon, T. J., Crowley, J. N.

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 736 KB

english, 2009

17

Back cover

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 573 KB

english, 2009

18

Electrochemical formation of Mg–Li–Ca alloys by codeposition of Mg, Li and Ca from LiCl–KCl–MgCl2–CaCl2 melts

Yan, Yong De, Zhang, Mi Lin, Xue, Yun, Han, Wei, Cao, Dian Xue, Jing, Xiao Yan, He, Li Yi, Yuan, Yi

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.45 MB

english, 2009

19

Front cover

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 223 KB

english, 2009

20

Structural, photophysical and photocatalytic properties of new Bi2SbVO7 under visible light irradiation

Luan, Jingfei, Pan, Bingcai, Paz, Yaron, Li, Yongmei, Wu, Xiaoshan, Zou, Zhigang

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 752 KB

english, 2009

21

Tuning the surface potential of gold substrates arbitrarily with self-assembled monolayers with mixed functional groups

Lin, Wei-Chun, Lee, Szu-Hsian, Karakachian, Manuel, Yu, Bang-Ying, Chen, Ying-Yu, Lin, Yu-Chin, Kuo, Che-Hung, Shyue, Jing-Jong

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.60 MB

english, 2009

22

The diatomic dication PO2+

Révész, Ágnes, Sztáray, Bálint, Schröder, Detlef, Franzreb, Klaus, Fišer, Jiří, Price, Stephen D., Roithová, Jana

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 997 KB

english, 2009

23

Incorporation and electron transfer of anthracene in pores of ZSM-5 zeolites. Effect of Brønsted acid site density

Hureau, Matthieu, Moissette, Alain, Marquis, Séverine, Brémard, Claude, Vezin, Hervé

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.28 MB

english, 2009

24

Layered hybrid organic–inorganic nanobelts exhibiting a field-induced magnetic transition

Cao, Minhua, Djerdj, Igor, Jagličić, Zvonko, Antonietti, Markus, Niederberger, Markus

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.33 MB

english, 2009

25

The 559-to-600 nm shift observed in red fluorescent protein eqFP611 is attributed to cis–trans isomerization of the chromophore in an anionic protein pocket

Yan, Weizhong, Xie, Daiqian, Zeng, Jun

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.28 MB

english, 2009

26

Molecular configuration transitions of a nematic liquid crystal encapsulated in organically modified silicas

Castellón, Erick, Zayat, Marcos, Levy, David

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.63 MB

english, 2009

27

Evidence for a ball-shaped cyclen cyclophane: an experimental and first principles study

Hill, Jonathan P., Scipioni, Roberto, Boero, Mauro, Wakayama, Yutaka, Akada, Misaho, Miyazaki, Tsuyoshi, Ariga, Katsuhiko

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.82 MB

english, 2009

28

One-step synthesis of uniform silver nanoparticles capped by saturated decanoate: direct spray printing ink to form metallic silver films

Dong, Teng-Yuan, Chen, Wei-Ting, Wang, Ching-Wen, Chen, Chiao-Pei, Chen, Chen-Ni, Lin, Ming-Cheng, Song, Jenn-Ming, Chen, In-Gann, Kao, Tzu-Hsuan

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.61 MB

english, 2009

29

Inside front cover

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 451 KB

english, 2009

30

Ligands bonded to metal ion or through-metal interacting ligands? Analysis of unusual bonds formation in the (BDTA)2[Co(mnt)2] material

Kepenekian, Mikaël, Le Guennic, Boris, Awaga, Kunio, Robert, Vincent

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.10 MB

english, 2009

31

Robust normal modes in vibrational circular dichroism spectra

Nicu, Valentin Paul, Baerends, Evert Jan

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.39 MB

english, 2009

32

On progeny droplets emitted during Coulombic fission of charged microdrops

Hunter, Harry C., Ray, Asit K.

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 721 KB

english, 2009

33

A modified electronegativity equalization method for fast and accurate calculation of atomic charges in large biological molecules

Ouyang, Yongzhong, Ye, Fei, Liang, Yizeng

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 620 KB

english, 2009

34

Supramolecular interactions of fullerenes with (Cl)Fe- and Mn porphyrins. A theoretical study

Liao, Meng-Sheng, Watts, John D., Huang, Ming-Ju

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.12 MB

english, 2009

35

Isomer selective infrared spectroscopy of supersonically cooled cis- and trans-N-phenylamides in the region from the amide band to NH stretching vibration

Miyazaki, Mitsuhiko, Saikawa, Jiro, Ishizuki, Hideki, Taira, Takunori, Fujii, Masaaki

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 609 KB

english, 2009

36

Study of the C(3P) + OH(X2Π) → CO(a3Π) + H(2S) reaction: fully global ab initio potential energy surfaces of the 12A″ and 14A″ excited states and non adiabatic couplings

Zanchet, Alexandre, Bussery-Honvault, Béatrice, Jorfi, Mohamed, Honvault, Pascal

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 795 KB

english, 2009

37

The use of heterogeneous chemistry for the characterization of functional groups at the gas/particle interface of soot and TiO2 nanoparticles

Setyan, A., Sauvain, J.-J., Rossi, M. J.

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 662 KB

english, 2009

38

The positive influence of electrochemical cyclic potentiodynamic passivation (CPP) of a SS316LS surface on its response to fibronectin and pre-osteoblasts

Shahryari, Arash, Azari, Fereshteh, Vali, Hojatollah, Omanovic, Sasha

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 696 KB

english, 2009

39

Structural evolution of Pt–Au nanoalloys during heating process: comparison of random and core-shell orderings

Yang, Zhen, Yang, Xiaoning, Xu, Zhijun, Liu, Shuyan

Journal:

Physical Chemistry Chemical Physics

Année:

2009

Langue:

english

Fichier:

PDF, 1.78 MB

english, 2009