Alkali Metal Doped Organic Molecules on Insulators: Charge Impact on the Optical Properties

2010 ◽  
Vol 22 (36) ◽  
pp. 4064-4070 ◽  
Author(s):  
Thomas Dienel ◽  
Andreas Krause ◽  
Ronald Alle ◽  
Roman Forker ◽  
Klaus Meerholz ◽  
...  
Keyword(s):  
Optical Properties ◽  
Alkali Metal ◽  
Organic Molecules ◽  
Metal Doped

Study on optical properties of alkali metal doped g-C3N4 and their photocatalytic activity for reduction of CO2

2020 ◽  
Vol 751 ◽  
pp. 137467 ◽  
Author(s):  
Hao Zhang ◽  
Yunqing Tang ◽  
Zhixiang Liu ◽  
Zhi Zhu ◽  
Xu Tang ◽  
...  
Keyword(s):  
Optical Properties ◽  
Photocatalytic Activity ◽  
Alkali Metal ◽  
Metal Doped ◽  
Reduction Of Co2

Computational Investigation of Hydrogen Adsorption by Alkali-Metal-Doped Organic Molecules: Role of Aromaticity

ChemPhysChem ◽  
2009 ◽  
Vol 10 (2) ◽  
pp. 427-435 ◽  
Author(s):  
Kancharlapally Srinivasu ◽  
Kuttay R. S. Chandrakumar ◽  
Swapan K. Ghosh
Keyword(s):  
Alkali Metal ◽  
Organic Molecules ◽  
Hydrogen Adsorption ◽  
Computational Investigation ◽  
Metal Doped

Optical properties of the alkali-metal-doped superconducting fullerenes:K3C60andRb3C60

1994 ◽  
Vol 49 (10) ◽  
pp. 7012-7025 ◽  
Author(s):  
L. Degiorgi ◽  
E. J. Nicol ◽  
O. Klein ◽  
G. Grüner ◽  
P. Wachter ◽  
...  
Keyword(s):  
Optical Properties ◽  
Alkali Metal ◽  
Metal Doped

Electronic and optical properties of alkali metal doped carbon nanotubes

2009 ◽  
Vol 246 (11-12) ◽  
pp. 2693-2698 ◽  
Author(s):  
Christian Kramberger ◽  
Hendrik Rauf ◽  
Martin Knupfer ◽  
Hidetsugu Shiozawa ◽  
David Batchelor ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Optical Properties ◽  
Alkali Metal ◽  
Electronic And Optical Properties ◽  
Metal Doped

scholarly journals Structural and Magnetic Properties of Potassium-Doped 2,3-DiMethylnaphthalene

Crystals ◽  
2021 ◽  
Vol 11 (6) ◽  
pp. 608
Author(s):  
Xiao-Lin Wu ◽  
Ren-Shu Wang ◽  
Hui Yang ◽  
Jie Zhang ◽  
Ming-An Fu ◽  
...  
Keyword(s):  
Benzene Ring ◽  
Organic Molecules ◽  
Magnetic Measurements ◽  
Ring Structure ◽  
Molar Ratio ◽  
First Principles Calculations ◽  
Paramagnetic Behavior ◽  
Polycyclic Aromatic ◽  
Metal Doped ◽  
Derivatives Of

The development of potential magnetic materials in metal-doped polycyclic aromatic hydrocarbons has been a research hotspot in recent years. Here we have successfully synthesized stable potassium-doped 2,3-dimethylnaphthalene samples. The combination of first-principles calculations and XRD results identifies that doping of potassium into 2,3-dimethylnaphthalene forms a monoclinic structure with a molar ratio of 1:2 between potassium and molecule. The red shifts in the Raman spectra indicate that potassium 4s electrons are transferred to the organic molecules. The magnetic measurements show that the doped materials exhibit a temperature-independent magnetization in the temperature region of 1.8–300 K, which is consistent with the Pauli paramagnetic behavior. This is distinct from the diamagnetism of pristine material. Compared to the previous focus on benzene ring structure, our study of aromatic hydrocarbon derivatives of benzene ring opens a new route for the development of this field.

Electronic Structure and Optical Properties of Non-Metals (N, F, P, Cl, S)-Doped Cubic NaTaO3 by Density Functional Theory

2009 ◽  
Vol 79-82 ◽  
pp. 1245-1248 ◽  
Author(s):  
Pei Lin Han ◽  
Xiao Jing Wang ◽  
Yan Hong Zhao ◽  
Chang He Tang
Keyword(s):  
Density Functional Theory ◽  
Optical Properties ◽  
Electronic Structure ◽  
Visible Light ◽  
Absorption Edge ◽  
Density Functional ◽  
Red Shift ◽  
Functional Theory ◽  
Photoactive Materials ◽  
Metal Doped

Electronic structure and optical properties of non-metals (N, S, F, P, Cl) -doped cubic NaTaO3 were investigated systematically by density functional theory (DFT). The results showed that the substitution of (N, S, P, Cl) for O in NaTaO3 was effective in narrowing the band-gap relative to the F-doped NaTaO3. The larger red shift of the absorption edge and the higher visible light absorption at about 520 nm were found for the (N and P)-doped NaTaO3. The excitation from the impurity states to the conduction band may account for the red shift of the absorption edge in an electron-deficiency non-metal doped NaTaO3. The obvious absorption in the visible light region for (N and P)-doped NaTaO3 provides an important guidance for the design and preparation of the visible light photoactive materials.

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