Structure, reactivity and electronic properties of Mn doped clusters

2013 ◽  
Vol 419 ◽  
pp. 86-89 ◽  
Author(s):  
Radhashyam Banerjee ◽  
Soumendu Datta ◽  
Abhijit Mookerjee
Keyword(s):  
Electronic Properties ◽  
Doped Clusters ◽  
Mn Doped

Dual‐Additive Assisted Chemical Vapor Deposition for the Growth of Mn‐Doped 2D MoS 2 with Tunable Electronic Properties

Small ◽  
2019 ◽  
Vol 16 (15) ◽  
pp. 1903181 ◽  
Author(s):  
Zhengyang Cai ◽  
Tianze Shen ◽  
Qi Zhu ◽  
Simin Feng ◽  
Qiangmin Yu ◽  
...  
Keyword(s):  
Chemical Vapor Deposition ◽  
Electronic Properties ◽  
Vapor Deposition ◽  
Chemical Vapor ◽  
Mn Doped

Investigation of magnetic and electronic properties of transition metal doped Sc2CT2(T = O, OH or F) using a first principles study

2016 ◽  
Vol 18 (18) ◽  
pp. 12914-12919 ◽  
Author(s):  
Jianhui Yang ◽  
Xuepiao Luo ◽  
Shaozheng Zhang ◽  
Liang Chen
Keyword(s):  
Transition Metal ◽  
Electronic Properties ◽  
First Principles ◽  
Two Dimensional ◽  
Spin Electronics ◽  
First Principles Study ◽  
Two Dimensional Materials ◽  
Metal Doped ◽  
Mn Doped

Cr- and Mn-doped Sc2CT2(T = OH, O, or F) systems are magnetic, which are promising two-dimensional materials in spin electronics applications.

Strain-mediated electronic properties of pristine and Mn-doped GaN monolayers

2018 ◽  
Vol 5 (4) ◽  
pp. 045001 ◽  
Author(s):  
Venus Sharma ◽  
Sunita Srivastava
Keyword(s):  
Electronic Properties ◽  
Mn Doped

Synthesis and structural, magnetic, thermal and electronic properties of Mn-doped ZnCr2Se4

2019 ◽  
Vol 238 ◽  
pp. 121901 ◽  
Author(s):  
Izabela Jendrzejewska ◽  
Tadeusz Groń ◽  
Jerzy Goraus ◽  
Michał Pilch ◽  
Ewa Pietrasik ◽  
...  
Keyword(s):  
Electronic Properties ◽  
Mn Doped

Electronic properties in Mn doped and pure NiO clusters

2013 ◽  
Author(s):  
Moumita Barman ◽  
Somnath Paul ◽  
A. Sarkar
Keyword(s):  
Electronic Properties ◽  
Mn Doped

A DFT study on structure, stabilities and electronic properties of double magnesium doped gold clusters

RSC Advances ◽  
2014 ◽  
Vol 4 (100) ◽  
pp. 56571-56581 ◽  
Author(s):  
Debajyoti Bhattacharjee ◽  
Bhupesh Kr. Mishra ◽  
Ramesh Ch. Deka
Keyword(s):  
Binding Energy ◽  
Electronic Properties ◽  
Gold Clusters ◽  
Dft Study ◽  
Structure And Stability ◽  
Au Clusters ◽  
Doped Clusters ◽  
The Stability

The doping of two Mg atoms on Au-clusters has considerable effects on the structure and stability of gold clusters. The doped clusters enhance the stability of pure Au-clusters as observed from the binding energy plot.

Theoretical investigation on structural and magnetic properties of Mn-doped and C co-doped Zn12Se12 nanoclusters

2020 ◽  
Vol 16 ◽  
Author(s):  
Liangyan Chen ◽  
Chao Fang ◽  
Weihua Liu
Keyword(s):  
Magnetic Properties ◽  
Density Functional ◽  
Theoretical Calculations ◽  
Density Functional Theory Calculation ◽  
Double Exchange ◽  
Building Blocks ◽  
Exchange Mechanism ◽  
Hole State ◽  
Doped Clusters ◽  
Mn Doped

Background: Mn doped ZnSe low dimensional materials are attractive for different biological labels, gene silencing and dilute-magnetic device. ZnSe clusters are one of the basic building blocks of quantum dots and even clusterassembled nanodevices, Stable structures of undoped ZnSe clusters were established by previous pioneering work, and the Mn doped ZnSe clusters had been investigated, but the stable cluster in ferromagnetic state haven't been found yet. Objective: Our work mainly concentrates on Mn doped clusters (Mn2Zn10Se12) and C codoped clusters (Mn2Zn10CSe11) structure, magnetic properties through theoretical calculations. Methods: First principle density functional theory calculation with Dmol3 are used to execute all calculations. Results: Mn atoms prefer to substitute nearest neighbor Zn atom sites in rhombi part, and C atom prefers to occupy Se atom sites with shortest Mn-C bond length in Zn12Se12 nanocluster doping. Mn doped clusters (Mn2Zn10Se12) were in antiferromagnetic states and the most stable C codoped clusters (Mn2Zn10CSe11) were in ferromagnetic states. Magnetic behavior localized at the 3d orbitals of transitional metal Mn, 4p orbital of atom Se and 2p orbital of C atom. Mn2Zn10Se12 clusters were in antiferromagnetic states as the p-d hybridization introduced Mn-Mn superexchange mechanism. For the ferromagnetism of Mn2Zn10Se12 nanocluster, hole mediated double exchange mechanism introduced by C atom p-d hole state hybridization has been suggested. Conclusion: The codoping of C atom can stabilize the ferromagnetism of clusters through hole mediated double exchange mechanism, which may be meaningful for the exploring materials for cluster-assembled spin-electronic devices.

Magnetic and Electronic Properties of Highly Mn-Doped β-NaGdF4 and β-NaEuF4 Nanoparticles with a Narrow Size Distribution

2020 ◽  
Vol 124 (33) ◽  
pp. 18194-18202 ◽  
Author(s):  
Lilli Schneider ◽  
Jannis Wehmeier ◽  
Ulf Wiedwald ◽  
Jari Rodewald ◽  
Vadim R. Galakhov ◽  
...  
Keyword(s):  
Electronic Properties ◽  
Size Distribution ◽  
Narrow Size Distribution ◽  
Mn Doped

Electronic properties of Mn-doped graphene

2021 ◽  
Author(s):  
Keyur Sangani ◽  
Ankur Dwivedi ◽  
Ankur Pandya ◽  
Shibu Pillai ◽  
Prafulla K. Jha
Keyword(s):  
Electronic Properties ◽  
Doped Graphene ◽  
Mn Doped
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