Physical Chemistry Chemical Physics

1

How well can new-generation density functional methods describe stacking interactions in biological systems?

Zhao, Yan, Truhlar, Donald G.

Journal:

Year:

2005

Language:

english

File:

PDF, 582 KB

english, 2005

2

Molecular dynamics simulation of room-temperature ionic liquid mixture of [bmim][BF4] and acetonitrile by a refined force field

Wu, Xiaoping, Liu, Zhiping, Huang, Shiping, Wang, Wenchuan

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 782 KB

english, 2005

3

Ultrafast transient lens spectroscopy of various C40 carotenoids: lycopene, β-carotene, (3R,3′R)-zeaxanthin, (3R,3′R,6′R)-lutein, echinenone, canthaxanthin, and astaxanthin

Kopczynski, Matthäus, Lenzer, Thomas, Oum, Kawon, Seehusen, Jaane, Seidel, Marco T., Ushakov, Vladimir G.

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 719 KB

english, 2005

4

Initial characterization of a blue-light sensing, phototropin-related protein from Pseudomonas putida: a paradigm for an extended LOV construct

Krauss, U., Losi, A., Gärtner, W., Jaeger, K.-E., Eggert, T.

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 711 KB

english, 2005

5

Low-temperature and high-pressure induced swelling of a hydrophobic polymer-chain in aqueous solution

Paschek, Dietmar, Nonn, Sascha, Geiger, Alfons

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 796 KB

english, 2005

6

Interlayer stacking disorder in zeolite beta family: a Raman spectroscopic study

Mihailova, B., Valtchev, V., Mintova, S., Faust, A.-C., Petkov, N., Bein, T.

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 931 KB

english, 2005

7

Infrared spectra of homogeneous and heterogeneous proton-bound dimers in the gas phase

Fridgen, Travis D., MacAleese, Luke, Maitre, Philippe, McMahon, Terry B., Boissel, Pierre, Lemaire, Joel

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 915 KB

english, 2005

8

Back cover

Journal:

Physical Chemistry Chemical Physics

Year:

2005

File:

PDF, 305 KB

2005

9

Inside front cover

Journal:

Physical Chemistry Chemical Physics

Year:

2005

File:

PDF, 345 KB

2005

10

Mode-selective excitation of coherent surface phonons on alkali-covered metal surfaces

Watanabe, Kazuya, TakagiDepartment of Advanced Materi, Noriaki, Matsumoto, Yoshiyasu

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 552 KB

english, 2005

11

The role of the radical-complex mechanism in the ozone recombination/dissociation reaction

Luther, Klaus, Oum, Kawon, Troe, Jürgen

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 1.10 MB

english, 2005

12

Interaction between co-deposited metals during stripping voltammetry at boron-doped diamond electrodes

Foord, John S., Eaton, Kirk, Hao, Wang, CrossleyPresent address: Department, Alison

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 624 KB

english, 2005

13

Solid C58 films

Böttcher, Artur, Weis, Patrick, Jester, Stefan-S., Löffler, Daniel, Bihlmeier, Angela, Klopper, Wim, Kappes, Manfred M.

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 853 KB

english, 2005

14

Chemical Science in China

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 816 KB

english, 2005

16

Analysis of the errors in explicitly correlated electronic structure theory

May, Andrew J., Valeev, Edward, Polly, Robert, Manby, Frederick R.

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 745 KB

english, 2005

17

Rotational spectra and structure of the Ar2–H2S complex: pulsed nozzle Fourier transform microwave spectroscopic and ab initio studies

Mandal, Pankaj K., Ramdass, Dharmender J., Arunan, E.

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 624 KB

english, 2005

18

Biomimetic silica formation: Analysis of the phosphate-induced self-assembly of polyamines

Lutz, Katharina, Gröger, Christian, Sumper, Manfred, Brunner, Eike

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 589 KB

english, 2005

19

Ultrafast nuclear dynamics induced by photodetachment of Ag2– and Ag2O2–: oxygen desorption from a molecular silver surface

Socaciu-Siebert, Liana D., Hagen, Jan, Le Roux, Jérôme, Popolan, Denisia, Vaida, Mihai, VajdaPermanent address: Argonne Nat, Štefan, Bernhardt, Thorsten M., Wöste, Ludger

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 538 KB

english, 2005

20

Quantum level structures at a Fermi resonance with angular momentum: classical periodic orbits, catastrophe maps and quantum monodromy

Cooper, C. D., Child, M. S.

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 656 KB

english, 2005

21

Properties of polythiophene and related conjugated polymers: a density-functional study

Asaduzzaman, Abu Md., Schmidt-D’Aloisio, Karla, Dong, Yi, Springborg, Michael

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 848 KB

english, 2005

22

Biaxial nematics: computer simulation studies of a generic rod–disc dimer model

Bates, Martin A., Luckhurst, Geoffrey R.

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 650 KB

english, 2005

23

Front cover

Journal:

Physical Chemistry Chemical Physics

Year:

2005

File:

PDF, 163 KB

2005

24

FTIR spectroscopic investigations of supersaturated NaClO4 aerosols

Zhao, Li-Jun, Zhang, Yun-Hong, Wang, Liang-Yu, Hu, Yong-An, Ding, Fei

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 672 KB

english, 2005

25

In situ XANES study of Mn in promoted sulfated zirconia catalysts

Jentoft, Rolf E., Hahn, Alexander H. P., Jentoft, Friederike C., Ressler, Thorsten

Journal:

Physical Chemistry Chemical Physics

Year:

2005

Language:

english

File:

PDF, 653 KB

english, 2005

Volume 7; Issue 14

How well can new-generation density functional methods describe stacking interactions in biological systems?

Molecular dynamics simulation of room-temperature ionic liquid mixture of [bmim][BF4] and acetonitrile by a refined force field

Ultrafast transient lens spectroscopy of various C40 carotenoids: lycopene, β-carotene, (3R,3′R)-zeaxanthin, (3R,3′R,6′R)-lutein, echinenone, canthaxanthin, and astaxanthin

Initial characterization of a blue-light sensing, phototropin-related protein from Pseudomonas putida: a paradigm for an extended LOV construct

Low-temperature and high-pressure induced swelling of a hydrophobic polymer-chain in aqueous solution

Interlayer stacking disorder in zeolite beta family: a Raman spectroscopic study

Infrared spectra of homogeneous and heterogeneous proton-bound dimers in the gas phase

Back cover

Inside front cover

Mode-selective excitation of coherent surface phonons on alkali-covered metal surfaces

The role of the radical-complex mechanism in the ozone recombination/dissociation reaction

Interaction between co-deposited metals during stripping voltammetry at boron-doped diamond electrodes

Solid C58 films

Contents

Chemical Science in China

Analysis of the errors in explicitly correlated electronic structure theory

Rotational spectra and structure of the Ar2–H2S complex: pulsed nozzle Fourier transform microwave spectroscopic and ab initio studies

Biomimetic silica formation: Analysis of the phosphate-induced self-assembly of polyamines

Ultrafast nuclear dynamics induced by photodetachment of Ag2– and Ag2O2–: oxygen desorption from a molecular silver surface

Quantum level structures at a Fermi resonance with angular momentum: classical periodic orbits, catastrophe maps and quantum monodromy

Properties of polythiophene and related conjugated polymers: a density-functional study

Biaxial nematics: computer simulation studies of a generic rod–disc dimer model

Front cover

FTIR spectroscopic investigations of supersaturated NaClO4 aerosols

In situ XANES study of Mn in promoted sulfated zirconia catalysts