Volume 20; Issue 38

Physical Chemistry Chemical Physics

Volume 20; Issue 38

1

Narrowing the gap between experimental and computational determination of methyl group dynamics in proteins

Hoffmann, Falk, Xue, Mengjun, Schäfer, Lars V., Mulder, Frans A. A.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 3.01 MB

english, 2018

2

The impact of lipid oxidation on the functioning of a lung surfactant model

Stachowicz-Kuśnierz, A., Cwiklik, L., Korchowiec, J., Rogalska, E., Korchowiec, B.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.38 MB

english, 2018

3

Temperature dependence of photophysical properties of a dinuclear C^N-cyclometalated Pt( ii ) complex with an intimate Pt–Pt contact. Zero-field splitting and sub-state decay rates of the lowest triplet

Deaton, Joseph C., Chakraborty, Arnab, Czerwieniec, Rafal, Yersin, Hartmut, Castellano, Felix N.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.43 MB

english, 2018

4

Polarization propagator theory and the entanglement between MO excitations

Millán, Leonardo A., Giribet, Claudia G., Aucar, Gustavo A.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.86 MB

english, 2018

5

Disorder in the hydrogen-atoms uninvolved in hydrogen bonds in a metal–organic framework

Viswanathan, M.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 4.30 MB

english, 2018

6

Identification of the maze in the conformational landscape of fenchol

Neeman, E. M., Huet, T. R.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.92 MB

english, 2018

7

Allosteric Na + -binding site modulates CXCR4 activation

Cong, Xiaojing, Golebiowski, Jérôme

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.17 MB

english, 2018

8

Reversible DNA compaction induced by partial intercalation of 16-Ph-16 gemini surfactants: evidence of triple helix formation

Grueso, Elia, Roldan, Emilio, Perez-Tejeda, Pilar, Kuliszewska, Edyta, Molero, Blanca, Brecker, Lothar, Giráldez-Pérez, R. M.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 8.14 MB

english, 2018

9

Hybrid DFT investigation of the energetics of Mg ion diffusion in α-MoO 3

Barnes, Taylor A., Wan, Liwen F., Kent, Paul R. C., Prendergast, David

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 2.48 MB

english, 2018

10

Correction: Transition path time distribution and the transition path free energy barrier

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.28 MB

english, 2018

11

[(H 2 O)Zn(Imidazole) n ] 2+ : the vital roles of coordination number and geometry in Zn–OH 2 acidity and catalytic hydrolysis

Linder, Douglas P., Baker, Brett E., Rodgers, Kenton R.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.92 MB

english, 2018

12

Study of volume and surface plasmons in small silicon–hydrogen nanoclusters using the GW method

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 2.03 MB

english, 2018

13

Unimolecular decomposition kinetics of the stabilised Criegee intermediates CH 2 OO and CD 2 OO

Stone, Daniel, Au, Kendrew, Sime, Samantha, Medeiros, Diogo J., Blitz, Mark, Seakins, Paul W., Decker, Zachary, Sheps, Leonid

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 2.90 MB

english, 2018

14

n-Type Ohmic contact and p-type Schottky contact of monolayer InSe transistors

Shi, Bowen, Wang, Yangyang, Li, Jingzhen, Zhang, Xiuying, Yan, Jiahuan, Liu, Shiqi, Yang, Jie, Pan, Yuanyuan, Zhang, Han, Yang, Jinbo, Pan, Feng, Lu, Jing

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 4.69 MB

english, 2018

15

Reaction kinetics of OH + HNO 3 under conditions relevant to the upper troposphere/lower stratosphere

Winiberg, Frank A. F., Percival, Carl J., Shannon, Robin, Khan, M. Anwar H., Shallcross, Dudley E., Liu, Yingdi, Sander, Stanley P.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 3.69 MB

english, 2018

16

Influence of conjugation length on ultrafast electronic tunneling in organic semiconductor thin films

Duong, Vincent V., Ayzner, Alexander L.

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 2.96 MB

english, 2018

17

Bridging solution properties to gas hydrate nucleation through guest dynamics

Zhang, Zhengcai, Kusalik, Peter G., Guo, Guang-Jun

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 2.37 MB

english, 2018

18

Systematic analysis of electron energy-loss near-edge structures in Li-ion battery materials

Saitoh, Motofumi, Gao, Xiang, Ogawa, Takafumi, Ikuhara, Yumi H., Kobayashi, Shunsuke, Fisher, Craig A. J., Kuwabara, Akihide, Ikuhara, Yuichi

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 3.03 MB

english, 2018

19

Inside back cover

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.23 MB

english, 2018