Volume 18; Issue 4

Physical Chemistry Chemical Physics

Volume 18; Issue 4

1

Flexibility at a glycosidic linkage revealed by molecular dynamics, stochastic modeling, and 13 C NMR spin relaxation: conformational preferences of α- l -Rhap-α-(1 → 2)-α- l -Rhap-OMe in water and dimethyl sulfoxide solutions

Pendrill, Robert, Engström, Olof, Volpato, Andrea, Zerbetto, Mirco, Polimeno, Antonino, Widmalm, Göran

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.71 MB

english, 2016

2

Paramagnetic spherical nanoparticles by the self-assembly of persistent trityl radicals

Marin-Montesinos, I., Paniagua, J. C., Peman, Alejandro, Vilaseca, M., Luis, F., Van Doorslaer, S., Pons, M.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.27 MB

english, 2016

3

Interactions in the ionic liquid [EMIM][FAP]: a coupled experimental and computational analysis

Voroshylova, Iuliia V., Teixeira, Filipe, Costa, Renata, Pereira, Carlos M., Cordeiro, M. Natália D. S.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.76 MB

english, 2016

4

Charge mobility induced by Brownian fluctuations in π-conjugated polymers in solution

Poole, Jessica Ellen, Damry, Djamshid Ahmud, Tozer, Oliver Robert, Barford, William

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.71 MB

english, 2016

5

Photodissociation dynamics of ICH 2 Cl → CH 2 Cl + I*/I: photofragment translational spectroscopy at 304 and 277 nm

Cheng, Min, Lin, Dan, Hu, Lili, Du, Yikui, Zhu, Qihe

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.02 MB

english, 2016

6

Mechanisms and energetics for N-glycosidic bond cleavage of protonated 2′-deoxyguanosine and guanosine

Wu, R. R., Chen, Yu, Rodgers, M. T.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 3.53 MB

english, 2016

7

Supported lipid bilayer repair mediated by AH peptide

Kim, Min Chul, Gunnarsson, Anders, Tabaei, Seyed R., Höök, Fredrik, Cho, Nam-Joon

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 3.62 MB

english, 2016

8

CO 2 adsorption–desorption performance of mesoporous zirconium hydroxide with robust water durability

Kamimura, Y., Endo, A.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.35 MB

english, 2016

9

Identification of the inhibitory mechanism of FDA approved selective serotonin reuptake inhibitors: an insight from molecular dynamics simulation study

Xue, Weiwei, Wang, Panpan, Li, Bo, Li, Yinghong, Xu, Xiaofei, Yang, Fengyuan, Yao, Xiaojun, Chen, Yu Zong, Xu, Feng, Zhu, Feng

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 3.72 MB

english, 2016

10

Azoniaspiro salts: towards bridging the gap between room-temperature ionic liquids and molten salts

Clough, Matthew T., Geyer, Karolin, Hunt, Patricia A., McIntosh, Alastair J. S., Rowe, Rebecca, Welton, Tom, White, Andrew J. P.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.64 MB

english, 2016

11

Pressure-induced mesoscopic disorder in protic ionic liquids: first computational study

Mariani, A., Caminiti, R., Campetella, M., Gontrani, L.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.54 MB

english, 2016

12

Distinct structural and dynamical difference between supercooled and normal liquids of hydrogen molecules

Hyeon-Deuk, Kim, Ando, Koji

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.63 MB

english, 2016

13

Gradual plasmon evolution and huge infrared near-field enhancement of metallic bridged nanoparticle dimers

Huang, Yu, Ma, Lingwei, Hou, Mengjing, Xie, Zheng, Zhang, Zhengjun

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.17 MB

english, 2016

14

Flexibility and conformation of the cocaine aptamer studied by PELDOR

Grytz, C. M., Marko, A., Cekan, P., Sigurdsson, S. Th., Prisner, T. F.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.54 MB

english, 2016

15

Reactive symbol sequences for a model of hydrogen combustion

Alaghemandi, Mohammad, Green, Jason R.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.45 MB

english, 2016

16

Optical design of ZnO-based antireflective layers for enhanced GaAs solar cell performance

Lee, Hye Jin, Lee, Jae Won, Kim, Hee Jun, Jung, Dae-Han, Lee, Ki-Suk, Kim, Sang Hyeon, Geum, Dae-myeong, Kim, Chang Zoo, Choi, Won Jun, Baik, Jeong Min

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.28 MB

english, 2016

17

Dielectric relaxations of polyether-based polyurethanes containing ionic liquids as antistatic agents

Tsurumaki, Akiko, Bertasi, Federico, Vezzù, Keti, Negro, Enrico, Di Noto, Vito, Ohno, Hiroyuki

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 3.43 MB

english, 2016

18

Pore orientation effects on the kinetics of mesostructure loss in surfactant templated titania thin films

Das, Saikat, Nagpure, Suraj, Garlapalli, Ravinder K., Wu, Qingliu, Islam, Syed Z., Strzalka, Joseph, Rankin, Stephen E.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 4.33 MB

english, 2016

19

Conversion of light-energy into molecular strain in the photocycle of the photoactive yellow protein

Gamiz-Hernandez, Ana P., Kaila, Ville R. I.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 3.48 MB

english, 2016

20

Playing with isomerism and N substitution in pentalenedione derivatives for organic electrode batteries: how high are the stakes?

Tomerini, Daniele, Gatti, Carlo, Frayret, Christine

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.84 MB

english, 2016

21

Metal adatoms generated by the co-play of melamine assembly and subsequent CO adsorption

Wang, Li, Chen, Qiwei, Shi, Hong, Liu, Huihui, Ren, Xinguo, Wang, Bing, Wu, Kai, Shao, Xiang

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.30 MB

english, 2016

22

Growth mechanisms of Pd nanofilms electrodeposited onto Au(111): an in situ grazing incidence X-ray diffraction study

Soldo-Olivier, Yvonne, De Santis, Maurizio, Liang, Wang, Sibert, Eric

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.47 MB

english, 2016

23

Unconventional CH δ+ ⋯N hydrogen bonding interactions in the stepwise solvation of the naphthalene radical cation by hydrogen cyanide and acetonitrile molecules

Platt, Sean P., Attah, Isaac K., El-Shall, M. S., Hilal, Rifaat, Elroby, Shaaban A., Aziz, Saadullah G.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 3.64 MB

english, 2016

24

Electrochemical studies of hydrogen chloride gas in several room temperature ionic liquids: mechanism and sensing

Murugappan, Krishnan, Silvester, Debbie S.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.91 MB

english, 2016

25

Relationship between vesicle size and steric hindrance influences vesicle rupture on solid supports

Jackman, Joshua A., Kim, Min Chul, Zhdanov, Vladimir P., Cho, Nam-Joon

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.74 MB

english, 2016

26

Hydrogen-bonding and vibrational coupling of water in a hydrophobic hydration shell as observed by Raman-MCR and isotopic dilution spectroscopy

Ahmed, Mohammed, Singh, Ajay K., Mondal, Jahur A.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.33 MB

english, 2016

27

Reducing the V 2 O 3 (0001) surface through electron bombardment – a quantitative structure determination with I/V-LEED

Feiten, Felix E., Kuhlenbeck, Helmut, Freund, Hans-Joachim

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 4.03 MB

english, 2016

28

Front cover

Journal:

Physical Chemistry Chemical Physics

Year:

2016

File:

PDF, 298 KB

2016

29

Inside front cover

Journal:

Physical Chemistry Chemical Physics

Year:

2016

File:

PDF, 394 KB

2016

30

Relaxation dynamics of helium nanodroplets after photodissociation of a dopant homonuclear diatomic molecule. The case of Cl 2 @( 4 He) N

Vilà, Arnau, González, Miguel, Mayol, Ricardo

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.46 MB

english, 2016

31

An experimental and theoretical study of core–valence double ionisation of acetaldehyde (ethanal)

Zagorodskikh, S., Vapa, M., Vahtras, O., Zhaunerchyk, V., Mucke, M., Eland, J. H. D., Squibb, R. J., Linusson, P., Jänkälä, K., Ågren, H., Feifel, R.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 3.18 MB

english, 2016

32

Investigation of sodium insertion into tetracyanoquinodimethane (TCNQ): results for a TCNQ thin film obtained by a surface science approach

Precht, R., Stolz, S., Mankel, E., Mayer, T., Jaegermann, W., Hausbrand, R.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.62 MB

english, 2016

33

Aggregation of binary colloidal suspensions on attractive walls

Laganapan, Aleena, Bochicchio, Davide, Bienia, Marguerite, Videcoq, Arnaud, Ferrando, Riccardo

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.81 MB

english, 2016

34

Contents list

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 16.48 MB

english, 2016

35

Correction: Design and characterisation of bodipy sensitizers for dye-sensitized NiO solar cells

Summers, Gareth H., Lefebvre, Jean-François, Black, Fiona A., Davies, E. Stephen, Gibson, Elizabeth A., Pullerits, Tönu, Wood, Christopher J., Zidek, Karel

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.27 MB

english, 2016

36

Complex doping chemistry owing to Mn incorporation in nanocrystalline anatase TiO 2 powders

Guo, Meilan, Gao, Yun, . Shao, G

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 4.39 MB

english, 2016

37

Correction: Towards the rationalization of catalytic activity values by means of local hyper-softness on the catalytic site: a criticism about the use of net electric charges

Martínez-Araya, Jorge Ignacio, Grand, André, Glossman-Mitnik, Daniel

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.27 MB

english, 2016

38

Simulations of iron K pre-edge X-ray absorption spectra using the restricted active space method

Guo, Meiyuan, Sørensen, Lasse Kragh, Delcey, Mickaël G., Pinjari, Rahul V., Lundberg, Marcus

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.65 MB

english, 2016

39

The CO oxidation mechanism on the W(111) surface and the W helical nanowire investigated by the density functional theory calculation

Lin, Ken-Huang, Ju, Shin-Pon, Li, Jia-Yun, Chen, Hsin-Tsung

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 3.26 MB

english, 2016

40

A very rapid electronic relaxation process in a highly conjugated Zn( ii )porphyrin–[26]hexaphyrin–Zn( ii )porphyrin hybrid tape

Lee, Sangsu, Mori, Hirotaka, Lee, Taegon, Lim, Manho, Osuka, Atsuhiro, Kim, Dongho

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.38 MB

english, 2016

41

Correction: The impact of doping rates on the morphologies of silver and gold nanowires grown in helium nanodroplets

Volk, Alexander, Thaler, Philipp, Knez, Daniel, Hauser, Andreas W., Steurer, Johannes, Grogger, Werner, Hofer, Ferdinand, Ernst, Wolfgang E.

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.28 MB

english, 2016

42

Inside back cover

Journal:

Physical Chemistry Chemical Physics

Year:

2016

File:

PDF, 480 KB

2016

43

Back cover

Journal:

Physical Chemistry Chemical Physics

Year:

2016

File:

PDF, 2.13 MB

2016

44

Inside back cover

Journal:

Physical Chemistry Chemical Physics

Year:

2016

File:

PDF, 480 KB

2016

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