Theoretical Study of the Electronic Structure of [TCNQ]22−(TCNQ = 7,7,8,8-Tetracyano-p-quinodimethane) Dimers and Their Intradimer, Long, Multicenter Bond in Solution and the Solid State

2009 ◽  
Vol 113 (25) ◽  
pp. 7124-7132 ◽  
Author(s):  
Iñigo Garcia-Yoldi ◽  
Joel S. Miller ◽  
Juan J. Novoa
Keyword(s):  
Electronic Structure ◽  
Solid State ◽  
Theoretical Study

Comment on “Pressure-induced structural and valence transition in AgO” by C. Hou, J. Botana, X. Zhang, X. Wang and M. Miao, Phys. Chem. Chem. Phys., 2016, 18, 15322

2016 ◽  
Vol 18 (46) ◽  
pp. 31973-31974 ◽  
Author(s):  
Mariana Derzsi ◽  
Wojciech Grochala
Keyword(s):  
Electronic Structure ◽  
Recent Article ◽  
Theoretical Study ◽  
Mixed Valence ◽  
Chem Phys ◽  
External Pressure ◽  
Valence Transition ◽  
Mixed Valence Compound ◽  
Phys Chem Chem Phys

The recent article by Hou et al. has focused on a theoretical study of mixed valence compound AgO in order to elucidate the nature of the electronic structure of this system as a function of external pressure.

ChemInform Abstract: Electronic Structure of Thiacyanine Dyes (I) in the Solid State

ChemInform ◽  
1989 ◽  
Vol 20 (35) ◽  
Author(s):  
T. B. TANG ◽  
H. YAMAMOTO ◽  
K. IMAEDA ◽  
H. INOKUCHI ◽  
K. SEKI ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Solid State

First principles study on the electronic structure properties of Keggin polyoxometalates on Carbon substrates for solid-state devices

2017 ◽  
Vol 136 (2) ◽  
Author(s):  
Jesús Muñiz ◽  
Christian Celaya ◽  
Ana Mejía-Ozuna ◽  
Ana Karina Cuentas-Gallegos ◽  
L. M. Mejía-Mendoza ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Solid State ◽  
First Principles ◽  
First Principles Study ◽  
Solid State Devices ◽  
Carbon Substrates ◽  
Structure Properties
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