Volume 359; Issue 1-3

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Chemical Physics
Volume 359; Issue 1-3

Chemical Physics

Volume 359; Issue 1-3

1

A CCSD(T) and ccCA study of mixed silicon hydrides and halides: Structures and thermochemistry

Brian P. Prascher, Rebecca M. Lucente-Schultz, Angela K. Wilson

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 359 KB

english, 2009

2

Mechanisms for pyrrole adsorption on the Si(1 1 1)7 × 7 surface: A DFT cluster model study

Xinyu Peng, Xueye Wang, Liming Liu, Yanling Wang, Yuanqiang Tan

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 1.20 MB

english, 2009

3

First principles studies of the electronic and magnetic structures of complex

L. Kabalan, S.F. Matar

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 722 KB

english, 2009

4

Monte-Carlo simulations of methane/carbon dioxide and ethane/carbon dioxide mixture adsorption in zeolites and comparison with matrix treatment of statistical mechanical lattice model

Lawrence J. Dunne, Akrem Furgani, Sayed Jalili, George Manos

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 254 KB

english, 2009

5

Oxygen dissociation – Influence of Xe metastable

G. Grigorian, A. Cenian

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 213 KB

english, 2009

6

An ab initio potential energy surface and vibrational energy levels of HXeO

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 610 KB

english, 2009

7

Chemical origin of red shift of CO stretching vibration in acetone complexes with various metal cations

Guiqiu Zhang, Wei Wang, Dezhan Chen

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 238 KB

english, 2009

8

Photophysical properties and thermochromic shifts of electronic spectra of Nile Red in selected solvents. Excited states dipole moments

A. Kawski, B. Kukliński, P. Bojarski

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 533 KB

english, 2009

9

Exciton migration and quenching in poly(propylene imine) dendrimers

I. Minevičiūtė, V. Gulbinas, M. Franckevičius, R. Vaišnoras, M. Marcos, J.L. Serrano

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 954 KB

english, 2009

10

Vibrational relaxation of CO2 (1 20 1) by argon

Z.T. Alwahabi, J. Zetterberg, Z.S. Li, M. Aldén

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 585 KB

english, 2009

11

Threshold photoelectron spectra of tetrahydrofuran over the energy range 9–29 eV

Marcin Dampc, Brygida Mielewska, Michele R.F. Siggel-King, George C. King, Mariusz Zubek

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 694 KB

english, 2009

12

The structures and electronic properties of Lan and LanO (n = 2–12) clusters

Z. Yang, Y.X. Wang, A.M. Guo, H.J. Zhu, S.J. Xiong

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 827 KB

english, 2009

13

Strong optical limiting effects of two Ag(I)-bridged metal-organic polymers

Hong Xu, Ying Lin Song, Xiang Ru Meng, Hong Wei Hou, Ming Sheng Tang, Yao Ting Fan

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 823 KB

english, 2009

14

Iodopentafluorobenzene: Electronic state spectroscopy by high-resolution vacuum ultraviolet photoabsorption and photoelectron spectroscopy

S. Eden, M.-J. Hubin-Franskin, J. Delwiche, S.V. Hoffmann, N.J. Mason, N.C. Jones

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 515 KB

english, 2009

15

Aqueous solvent effects on structure and lowest electronic transition of methylene peroxide in an explicit solvent model

Jose Manuel Hermida-Ramón, Anders Öhrn, Gunnar Karlström

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 511 KB

english, 2009

16

Theoretical calculation of atmospheric reactions. The case of CH3–CHxOH(CH3)1−x–CHy(CH3)3−y, (x = 1,0; y = 2,1) + Cl

Andrés Garzón, Mónica Moral, Alberto Notario, José Albaladejo, Manuel Fernández-Gómez

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 620 KB

english, 2009

17

Dehydrogenation of ethanol on an O2–4Rh/CeO2−x(1 1 1) surface: A computational study

Han-Jung Li, Hui-Lung Chen, Shih-Feng Peng, Jia-Jen Ho

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 937 KB

english, 2009

18

Oxidation of deposited Aun (n = 2–13) on SiO2/Si: Influence of the NaOH(aq) treatment

Dong Chan Lim, Rainer Dietsche, Gerd Ganteför, Young Dok Kim

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 1.06 MB

english, 2009

19

Photoexcitation mechanisms of centrosymmetric and asymmetric fluorene derivatives in two-photon absorption

Mengtao Sun, Yong Ding, Lili Zhao, Fengcai Ma

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 660 KB

english, 2009

20

IFC (Editorial Board)

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 39 KB

english, 2009

21

Subject Index

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 118 KB

english, 2009

22

Geometry and Raman spectra of P.R. 255 and its furo-furanone analogue

Stanislav Luňák Jr., Božena Frumarová, Jan Vyňuchal, Radim Hrdina

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 647 KB

english, 2009

23

Comparative evaluation of the acceptor properties of quinone derivatized polypyridinic ligands

Ester Norambuena, Claudio Olea-Azar, Álvaro Delgadillo, Mauricio Barrera, Bárbara Loeb

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 875 KB

english, 2009

24

Theoretical study of noncovalent interactions between triple bonds and chlorine atoms in complexes of acetylene and some chloromethanes

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 286 KB

english, 2009

25

Relation between the OH stretching frequency and the OO distance in time-resolved infrared spectroscopy of hydrogen bonding

Savo Bratos, Jean-Claude Leicknam, Stanislas Pommeret

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 430 KB

english, 2009

26

Quasi-classical trajectory study of the reaction dynamics of Ca(1S0,3P) atoms with CHCl3

Li Yao, Haiyang Zhong, Yonglu Liu, Wenwen Xia

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 352 KB

english, 2009

27

Is the Kohlrausch function a good tool to account for nonexponentiality in Thermally Stimulated Depolarisation Currents (TSDC) data treatment?

Maria Teresa Viciosa, Gabriel Pires, Joaquim J. Moura Ramos

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 400 KB

english, 2009

28

First-principles study of hydrogen storage over Ni and Rh doped BN sheets

Natarajan Sathiyamoorthy Venkataramanan, Mohammad Khazaei, Ryoji Sahara, Hiroshi Mizuseki, Yoshiyuki Kawazoe

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 787 KB

english, 2009

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