Chemical Physics

1

A DFT study of the interaction between large PAHs and atomic chlorine or hydrogen chloride molecule: Toward a modelling of the influence of chlorinated species on the trapping of water by soot

Garcia-Fernandez, C., Radola, B., Martin-Gondre, L., Picaud, S., Rayez, M.T., Rayez, J.C., Ouf, F.X., Rubayo-Soneira, J.

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 1.38 MB

english, 2017

2

Vacuum FTIR observation on hygroscopic properties and phase transition of malonic acid aerosols

Shao, Xu, Zhang, Yun, Pang, Shu-Feng, Zhang, Yun-Hong

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 1.10 MB

english, 2017

3

Effects of occupation-numbers in (3d–5d) and U energy on transport and magnetic properties of complex perovskites Pb2MReO6 (M=Cr, Mn and Fe) by LSDA and LSDA+U methods

Musa Saad H.-E., M.

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 5.16 MB

english, 2017

4

Comparison of noncovalent interactions of zigzag and armchair carbon nanotubes with heterocyclic and aromatic compounds: Imidazole and benzene, imidazophenazines, and tetracene

Zarudnev, Eugene S., Stepanian, Stepan G., Adamowicz, Ludwik, Leontiev, Victor S., Karachevtsev, Victor A.

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 2.22 MB

english, 2017

5

Spin-orbit coupling mechanism of singlet oxygen a

Minaev, B.F.

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 931 KB

english, 2017

6

The growth model and electronic properties of single- and double-walled zigzag silicon nanotubes: Depending on the structures

Lin, Xiang, Lu, Junzhe, Liu, Jing, Tang, Yuchao, Zhu, Hengjiang

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 1.74 MB

english, 2017

7

Properties of aqueous solutions of nonionic surfactants, Triton X-114 and Tween 80, at temperatures from 293 to 318K: Spectroscopic and ultrasonic studies

Szymczyk, Katarzyna, Taraba, Anna

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 2.09 MB

english, 2017

8

A theoretical study of molecular structure, optical properties and bond activation of energetic compound FOX-7 under intense electric fields

Tao, Zhiqiang, Wang, Xin, Wei, Yuan, Lv, Li, Wu, Deyin, Yang, Mingli

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 1.48 MB

english, 2017

9

Influence of water concentrations on the phase transformation of a model surfactant/co-surfactant/water system

Lunkad, Raju, Srivastava, Arpita, Debnath, Ananya

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 2.27 MB

english, 2017

10

Importance of pH-regulated charge density on the electrophoresis of soft particles

Gopmandal, Partha P., Ohshima, H.

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 462 KB

english, 2017

11

Poole-Frenkel mobility field dependence in molecularly doped polymers revisited

Tyutnev, A.P., Saenko, V.S.

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 569 KB

english, 2017

12

Robust control of photoassociation of slow O+H collision

Zhang, Wei, Dong, Daoyi, Petersen, Ian R., Rabitz, Herschel A.

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 1.11 MB

english, 2017

13

Effect of annealing on the sub-bandgap, defects and trapping states of ZnO nanostructures

Wahyuono, Ruri Agung, Hermann-Westendorf, Felix, Dellith, Andrea, Schmidt, Christa, Dellith, Jan, Plentz, Jonathan, Schulz, Martin, Presselt, Martin, Seyring, Martin, Rettenmeyer, Markus, Dietzek, Ben

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 2.34 MB

english, 2017

14

Asymmetric Stark shift in an impurity doped dome-shaped quantum dot with wetting layer

Niculescu, E.C., Cristea, M., Bejan, D.

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 860 KB

english, 2017

15

(NH4)2SO4 heterogeneous nucleation and glycerol evaporation of (NH4)2SO4-glycerol system in its dynamic efflorescence process

Cai, Chen, Luan, Ye-mei, Shi, Xiao-min, Zhang, Yun-hong

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 2.39 MB

english, 2017

16

Luminescence in collision-induced dissociation of ND3 by H+, H2+, and H3+ beams at energies below 1000eV

Drozdowski, R., Werbowy, S., Kowalski, A., Pranszke, B.

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 878 KB

english, 2017

17

IFC (Editorial Board)

Journal:

Chemical Physics

Year:

2017

Language:

english

File:

PDF, 31 KB

english, 2017

18

Volume 483-484

A DFT study of the interaction between large PAHs and atomic chlorine or hydrogen chloride molecule: Toward a modelling of the influence of chlorinated species on the trapping of water by soot

Vacuum FTIR observation on hygroscopic properties and phase transition of malonic acid aerosols

Effects of occupation-numbers in (3d–5d) and U energy on transport and magnetic properties of complex perovskites Pb2MReO6 (M=Cr, Mn and Fe) by LSDA and LSDA+U methods

Comparison of noncovalent interactions of zigzag and armchair carbon nanotubes with heterocyclic and aromatic compounds: Imidazole and benzene, imidazophenazines, and tetracene

Spin-orbit coupling mechanism of singlet oxygen a

The growth model and electronic properties of single- and double-walled zigzag silicon nanotubes: Depending on the structures

Properties of aqueous solutions of nonionic surfactants, Triton X-114 and Tween 80, at temperatures from 293 to 318K: Spectroscopic and ultrasonic studies

A theoretical study of molecular structure, optical properties and bond activation of energetic compound FOX-7 under intense electric fields

Influence of water concentrations on the phase transformation of a model surfactant/co-surfactant/water system

Importance of pH-regulated charge density on the electrophoresis of soft particles

Poole-Frenkel mobility field dependence in molecularly doped polymers revisited

Robust control of photoassociation of slow O+H collision

Effect of annealing on the sub-bandgap, defects and trapping states of ZnO nanostructures

Asymmetric Stark shift in an impurity doped dome-shaped quantum dot with wetting layer

(NH4)2SO4 heterogeneous nucleation and glycerol evaporation of (NH4)2SO4-glycerol system in its dynamic efflorescence process

Luminescence in collision-induced dissociation of ND3 by H+, H2+, and H3+ beams at energies below 1000eV

IFC (Editorial Board)

Contents