Volume 16; Issue 8

Physical Chemistry Chemical Physics

Volume 16; Issue 8

1

10.1039/C3CP52841C

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 1.88 MB

english

2

Direct evidence of hydrogen-atom tunneling dynamics in the excited state hydrogen transfer (ESHT) reaction of phenol–ammonia clusters

Rodríguez, J. D., González, M. G., Rubio-Lago, L., Bañares, L.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.10 MB

english, 2014

3

Initial stages of Cu3Au(111) oxidation: oxygen induced Cu segregation and the protective Au layer profile

Tsuda, Yasutaka, Oka, Kohei, Makino, Takamasa, Okada, Michio, Diño, Wilson Agerico, Hashinokuchi, M., Yoshigoe, Akitaka, Teraoka, Yuden, Kasai, Hideaki

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.21 MB

english, 2014

4

On the coupling of solvent characteristics to the electronic structure of solute molecules

Bogatko, Stuart, Cauët, Emilie, Geerlings, Paul, De Proft, Frank

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.73 MB

english, 2014

5

Large splittings of the 4f shell of Ce3+ in garnets

Seijo, Luis, Barandiarán, Zoila

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 567 KB

english, 2014

6

Structure and thermal properties of salicylate-based-protic ionic liquids as new heat storage media. COSMO-RS structure characterization and modeling of heat capacities

Jacquemin, Johan, Feder-Kubis, Joanna, Zorębski, Michał, Grzybowska, Katarzyna, Chorążewski, Mirosław, Hensel-Bielówka, Stella, Zorębski, Edward, Paluch, Marian, Dzida, Marzena

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.52 MB

english, 2014

7

The importance of timescale for hydrogen bonding in imidazolium chloride ionic liquids

Skarmoutsos, Ioannis, Welton, Tom, Hunt, Patricia A.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 5.66 MB

english, 2014

8

Does the tautomeric status of the adenine bases change upon the dissociation of the A*·Asyn Topal–Fresco DNA mismatch? A combined QM and QTAIM atomistic insight

Brovarets', Ol'ha O., Zhurakivsky, Roman O., Hovorun, Dmytro M.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.26 MB

english, 2014

9

Lithium diffusion in congruent LiNbO3 single crystals at low temperatures probed by neutron reflectometry

Hüger, E., Rahn, J., Stahn, J., Geue, T., Heitjans, P., Schmidt, H.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.44 MB

english, 2014

10

Raman characterization of pseudocapacitive behavior of polypyrrole on nanoporous gold

Hou, Y., Zhang, L., Chen, L. Y., Liu, P., Hirata, A., Chen, M. W.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.90 MB

english, 2014

11

Photoelectrochemical scanning droplet cell microscopy for localized photovoltaic investigations on organic semiconductors

Gasiorowski, Jacek, Kollender, Jan Philipp, Hingerl, Kurt, Sariciftci, Niyazi Serdar, Mardare, Andrei Ionut, Hassel, Achim Walter

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.15 MB

english, 2014

12

Assessing capability of semiconductors to split water using ionization potentials and electron affinities only

Stevanović, Vladan, Lany, Stephan, Ginley, David S., Tumas, Willam, Zunger, Alex

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.89 MB

english, 2014

13

Ionic liquid modulation of swelling and LCST behavior of N-isopropylacrylamide polymer gels

Gallagher, Simon, Kavanagh, Andrew, Zíołkowski, Bartosz, Florea, Larisa, MacFarlane, Douglas R., Fraser, Kevin, Diamond, Dermot

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.75 MB

english, 2014

14

Epitaxial graphene on SiC{0001}: advances and perspectives

Norimatsu, Wataru, Kusunoki, Michiko

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 5.14 MB

english, 2014

15

10.1039/C3CP54065K

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 1.57 MB

english

16

Dynamics and stability of lipid bilayers modulated by thermosensitive polypeptides, cholesterols, and PEGylated lipids

Lee, Hwankyu, Kim, Hyun Ryoung, Park, Jae Chan

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.62 MB

english, 2014

17

The molecular and magnetic structure of carbon-enclosed and partially covered Fe55 particles

Taubert, Stefan, Laasonen, Kari

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.70 MB

english, 2014

18

Experimental and theoretical study on the sensing mechanism of a fluorescence probe for hypochloric acid: a Se⋯N nonbonding interaction modulated twisting process

Lou, Zhangrong, Yang, Songqiu, Li, Peng, Zhou, Panwang, Han, Keli

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.97 MB

english, 2014

19

Experimental and theoretical study of the electronic properties of Cu-doped anatase TiO2

Navas, Javier, Sánchez-Coronilla, Antonio, Aguilar, Teresa, Hernández, Norge C., de los Santos, Desireé M., Sánchez-Márquez, Jesús, Zorrilla, David, Fernández-Lorenzo, Concha, Alcántara, Rodrigo, Mart

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 3.05 MB

english, 2014

20

Theoretical investigation of the effects of doping on the electronic structure and thermoelectric properties of ZnO nanowires

Wang, Chao, Wang, Yuanxu, Zhang, Guangbiao, Peng, Chengxiao, Yang, Gui

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.06 MB

english, 2014

21

In situ IR spectroscopic studies of Ni surface segregation induced by CO adsorption on Cu–Ni/SiO2 bimetallic catalysts

Yao, Yunxi, Goodman, D. Wayne

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.48 MB

english, 2014

22

CO2-induced micelle to vesicle transition in zwitterionic–anionic surfactant systems

Li, Wei, Yang, Yanjuan, Luo, Tian, Zhang, Jianling, Han, Buxing

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.57 MB

english, 2014

23

Electronic and magnetic structures of coronene-based graphitic nanoribbons

de Aguiar, Acrísio Lins, Saraiva-Souza, Aldilene, Bullard, Zachary, Maia, Dayvison Weber, Souza Filho, Antônio Gomes, Girão, Eduardo Costa, Meunier, Vincent

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.19 MB

english, 2014

24

A steered molecular dynamics mediated hit discovery for histone deacetylases

Kalyaanamoorthy, Subha, Chen, Yi-Ping Phoebe

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 3.71 MB

english, 2014

25

X-ray absorption spectroscopy and resonant inelastic scattering study of the first lithiation cycle of the Li-ion battery cathode Li2−xMnSiO4

Kristiansen, P. T., Dahbi, M., Gustafsson, T., Edström, K., Newby, D., Smith, K. E., Duda, L.-C.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.10 MB

english, 2014

26

Exploring and rationalising effective n-doping of large area CVD-graphene by NH3

Bianco, G. V., Losurdo, M., Giangregorio, M. M., Capezzuto, P., Bruno, G.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.48 MB

english, 2014

27

Optical and electronic properties of graphene nanoribbons upon adsorption of ligand-protected aluminum clusters

Gomes da Rocha, Claudia, Clayborne, P. Andre, Koskinen, Pekka, Häkkinen, Hannu

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.35 MB

english, 2014

28

Ag-nanoparticles-decorated NiO-nanoflakes grafted Ni-nanorod arrays stuck out of porous AAO as effective SERS substrates

Zhou, Qitao, Meng, Guowen, Huang, Qing, Zhu, Chuhong, Tang, Haibin, Qian, Yiwu, Chen, Bin, Chen, Bensong

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.44 MB

english, 2014

29

A combined experimental and theoretical study of reactions between the hydroxyl radical and oxygenated hydrocarbons relevant to astrochemical environments

Shannon, R. J., Caravan, R. L., Blitz, M. A., Heard, D. E.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.95 MB

english, 2014

30

Long-range proton-coupled electron transfer in phenol–Ru(2,2′-bipyrazine)32+ dyads

Bronner, Catherine, Wenger, Oliver S.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.49 MB

english, 2014

31

10.1039/c3cp54459a

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 1.70 MB

english

32

10.1039/c3cp54041c

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 1.35 MB

english

33

The kinetics and product state distributions from gas-phase reactions of small atomic and molecular cations with C2H4, C2H3F, 1,1-C2H2F2, C2HF3 and C2F4

Parkes, Michael A., Simpson, Matthew J., Mikhailov, Victor, Tuckett, Richard P.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.66 MB

english, 2014

34

Weak hydrogen bonding motifs of ethylamino neurotransmitter radical cations in a hydrophobic environment: infrared spectra of tryptamine+–(N2)n clusters (n ≤ 6)

Sakota, Kenji, Schütz, Markus, Schmies, Matthias, Moritz, Raphael, Bouchet, Aude, Ikeda, Takamasa, Kouno, Yuuki, Sekiya, Hiroshi, Dopfer, Otto

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.42 MB

english, 2014

35

10.1039/c3cp54073a

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 1.33 MB

english

36

Evolution of nanoscale amorphous, crystalline and phase-segregated PtNiP nanoparticles and their electrocatalytic effect on methanol oxidation reaction

Ma, Yanjiao, Wang, Rongfang, Wang, Hui, Linkov, Vladimir, Ji, Shan

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 3.40 MB

english, 2014

37

Reactions of HOCO radicals through hydrogen-atom hopping utilizing clathrate hydrates as an observational matrix

Oshima, Motoi, Tani, Atsushi, Sugahara, Takeshi, Kitano, Katsuhisa, Ohgaki, Kazunari

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.07 MB

english, 2014

38

Astrochemistry

Brown, Wendy A.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 892 KB

english, 2014

39

Theoretical prediction of carbon dioxide reduction to methane at coordinatively unsaturated ferric site in the presence of Cu impurities

Xiao, Jianping, Frauenheim, Thomas

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.76 MB

english, 2014

40

Strain-assisted, low-temperature synthesis of high-performance thermoelectric materials

Jung, Sung-Jin, Kim, Ju-Heon, Kim, Dong-Ik, Kim, Seong Keun, Park, Hyung-Ho, Kim, Jin-Sang, Hyun, Dow-Bin, Baek, Seung-Hyub

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.68 MB

english, 2014

41

Front cover

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.21 MB

english, 2014

42

Improving O2 production of WO3 photoanodes with IrO2 in acidic aqueous electrolyte

Spurgeon, Joshua M., Velazquez, Jesus M., McDowell, Matthew T.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.49 MB

english, 2014

43

A new insight into the 5-carboxycytosine and 5-formylcytosine under typical bisulfite conditions: a deamination mechanism study

Jin, Lingxia, Wang, Wenliang, Hu, Daodao, Lü, Jian

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 5.29 MB

english, 2014

44

Temperature-dependent photocatalytic hydrogen evolution activity from water on a dye-sensitized layered titanate

Matsuoka, Mizuki, Ide, Yusuke, Ogawa, Makoto

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.17 MB

english, 2014

45

Atomic oxygen diffusion on and desorption from amorphous silicate surfaces

He, Jiao, Jing, Dapeng, Vidali, Gianfranco

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.51 MB

english, 2014

46

Glass transition and mixing thermodynamics of a binary eutectic system

Tu, Wenkang, Chen, Zeming, Gao, Yanqin, Li, Zijing, Zhang, Yaqi, Liu, Riping, Tian, Yongjun, Wang, Li-Min

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.63 MB

english, 2014

47

10.1039/c3cp54027h

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 2.21 MB

english

48

Porosity and thermal collapse measurements of H2O, CH3OH, CO2, and H2O:CO2 ices

Isokoski, K., Bossa, J.-B., Triemstra, T., Linnartz, H.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.89 MB

english, 2014

49

Cysteine inhibits the fibrillisation and cytotoxicity of amyloid-β 40 and 42: implications for the contribution of the thiophilic interaction

Takai, Eisuke, Uda, Ken, Yoshida, Tomonori, Zako, Tamotsu, Maeda, Mizuo, Shiraki, Kentaro

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 3.23 MB

english, 2014

50

Hydration properties of lanthanoid(iii) carbonate complexes in liquid water determined by polarizable molecular dynamics simulations

Martelli, Fausto, Jeanvoine, Yannick, Vercouter, Thomas, Beuchat, César, Vuilleumier, Rodolphe, Spezia, Riccardo

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.10 MB

english, 2014

51

Contents list

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 7.40 MB

english, 2014

52

The structure and dynamics of carbon dioxide and water containing ices investigated via THz and mid-IR spectroscopy

Allodi, Marco A., Ioppolo, Sergio, Kelley, Matthew J., McGuire, Brett A., Blake, Geoffrey A.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 4.77 MB

english, 2014

53

The interaction of carbon monoxide with model astrophysical surfaces

Collings, Mark P., Dever, John W., McCoustra, Martin R. S.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.25 MB

english, 2014

54

Back cover

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.54 MB

english, 2014

55

10.1039/c3cp53153h

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 1.45 MB

english

56

10.1039/c3cp52850b

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 1.47 MB

english

57

10.1039/c3cp54034k

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 2.65 MB

english

58

10.1039/c3cp54255f

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 7.11 MB

english

59

A Ru–Co hybrid material based on a molecular photosensitizer and a heterogeneous catalyst for light-driven water oxidation

Wang, Hong-Yan, Liu, Jia, Zhu, Jiefang, Styring, Stenbjörn, Ott, Sascha, Thapper, Anders

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.60 MB

english, 2014

60

A dumbbell-like A–D–A molecule for single-component organic solar cells

Cao, Jiamin, Du, Xiaoyan, Chen, Shan, Xiao, Zuo, Ding, Liming

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.30 MB

english, 2014

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