Insights into the electrochemical capacitor performance of transition metal–vertical graphene nanosheet hybrid electrodes

2019 ◽  
Vol 21 (45) ◽  
pp. 25196-25205 ◽  
Author(s):  
Gopinath Sahoo ◽  
S. R. Polaki ◽  
P. Anees ◽  
Subrata Ghosh ◽  
Sandip Dhara ◽  
...  
Keyword(s):  
Electrical Conductivity ◽  
Charge Transfer ◽  
Transition Metal ◽  
Dft Calculations ◽  
Ab Initio ◽  
Electrochemical Capacitor ◽  
Electrochemical Capacitance ◽  
Graphene Nanosheet ◽  
Capacitor Performance

The enhanced electrochemical capacitance of the transition metal-vertical graphene nanosheet hybrid electrodes are correlated with the increase in charge transfer supported ab initio DFT calculations and increase in electrical conductivity.

Two photon absorption properties of four coordinated transition metal complexes of tetraarylazadipyrromethene compounds

2016 ◽  
Vol 18 (6) ◽  
pp. 4451-4459 ◽  
Author(s):  
E. Akhüseyin ◽  
O. Türkmen ◽  
B. Küçüköz ◽  
H. Yılmaz ◽  
A. Karatay ◽  
...  
Keyword(s):  
Charge Transfer ◽  
Transition Metal ◽  
Dft Calculations ◽  
Transition Metal Complexes ◽  
Photon Absorption ◽  
Absorption Properties ◽  
Pump Probe ◽  
Two Photon Absorption ◽  
Two Photon ◽  
Probe Spectroscopy

The effects of metals and substituents on the charge transfer mechanism and TPA properties of tetraarylazadipyrromethene compounds were investigated by ultrafast pump–probe spectroscopy, OA Z-scan experiments and DFT calculations.

New developments in the ab initio determination of transition metal alloys phase diagram

1993 ◽  
Vol 90 ◽  
pp. 249-254 ◽  
Author(s):  
C Wolverton ◽  
M Asta ◽  
S Ouannasser ◽  
H Dreyssé ◽  
D de Fontaine
Keyword(s):  
Phase Diagram ◽  
Transition Metal ◽  
Ab Initio ◽  
Metal Alloys ◽  
New Developments ◽  
Transition Metal Alloys

scholarly journals Ab Initio Calculation of Surface Thermochemistry for Popular Solid Transition Metal-Based Species

ACS Omega ◽  
2021 ◽  
Author(s):  
Muhammad Fahad Arshad ◽  
Ling-Nan Wu ◽  
Achraf El Kasmi ◽  
Wu Qin ◽  
Zhen-Yu Tian
Keyword(s):  
Transition Metal ◽  
Ab Initio ◽  
Ab Initio Calculation
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