Multiphoton Light Emission in Barium Stannate Perovskite Driven by Oxygen Vacancy, Eu3+ and La3+: Accessing the Role of Defect and Local Structure

2021 ◽  
Author(s):  
Santosh Kumar Gupta ◽  
Brindaban Modak ◽  
Debarati Das ◽  
Pampa Modak ◽  
Ashok Kumar Yadav ◽  
...  
Keyword(s):  
Oxygen Vacancy ◽  
Uv Irradiation ◽  
Local Structure ◽  
Light Emission ◽  
Defect Engineering ◽  
Efficient Approach ◽  
Barium Stannate ◽  
Photon Conversion ◽  
Visible Photon

Defect engineering in perovskite has found to be the most efficient approach to manipulate their performance in ultraviolet-to-visible photon conversion. On UV irradiation BaSnO3 depicted multi color photoluminescence (MCPL) in...

Engineering Porosity Through Defects in a Giant Pore Metal–Organic Framework

2020 ◽  
Author(s):  
Adam Sapnik ◽  
Duncan Johnstone ◽  
Sean M. Collins ◽  
Giorgio Divitini ◽  
Alice Bumstead ◽  
...  
Keyword(s):  
Distribution Function ◽  
Ball Milling ◽  
Local Structure ◽  
Pair Distribution Function ◽  
Function Analysis ◽  
Metal Organic Framework ◽  
Metal Organic Frameworks ◽  
Defect Engineering ◽  
Metal Organic ◽  
Unsaturated Metal Sites

<p>Defect engineering is a powerful tool that can be used to tailor the properties of metal–organic frameworks (MOFs). Here, we incorporate defects through ball milling to systematically vary the porosity of the giant pore MOF, MIL-100 (Fe). We show that milling leads to the breaking of metal–linker bonds, generating more coordinatively unsaturated metal sites, and ultimately causes amorphisation. Pair distribution function analysis shows the hierarchical local structure is partially</p><p>retained, even in the amorphised material. We find that the solvent toluene stabilises the MIL-100 (Fe) framework against collapse and leads to a substantial rentention of porosity over the non-stabilised material.</p>

scholarly journals Conversion of Methanol on Rutile TiO2 (110) and Tungsten Oxide Clusters: 2. The Role of Defects and Electron Transfer in Bifunctional Oxidic Photocatalysts

2021 ◽  
Author(s):  
Lars Mohrhusen ◽  
Jessica Kräuter ◽  
Katharina Al-Shamery
Keyword(s):  
Electron Transfer ◽  
Transition Metal ◽  
Metal Oxide ◽  
Tungsten Oxide ◽  
Organic Compounds ◽  
Uv Irradiation ◽  
Organic P ◽  
Rutile Tio2 ◽  
Metal Oxide Surfaces

The photochemical conversion of organic compounds on tailored transition metal oxide surfaces by (UV) irradiation has found wide applications ranging from the production of chemicals to the degradation of organic...

Role of Fe Doping on Local Structure and Electrical and Magnetic Properties of PbTiO3

2021 ◽  
Author(s):  
Hasitha Ganegoda ◽  
Soham Mukherjee ◽  
Beihai Ma ◽  
Daniel T. Olive ◽  
James H. McNeely ◽  
...  
Keyword(s):  
Magnetic Properties ◽  
Local Structure ◽  
Fe Doping ◽  
Electrical And Magnetic Properties

The critical role of the coordination sphere in the high-efficiency blue-light emission from aminopyrazine metal-organic polymers

2021 ◽  
Vol 186 ◽  
pp. 109025
Author(s):  
João Humberto Dias Campos ◽  
Meiry Edivirges Alvarenga ◽  
Maykon Alves Lemes ◽  
José Antônio do Nascimento Neto ◽  
Freddy Fernandes Guimarães ◽  
...  
Keyword(s):  
Blue Light ◽  
Coordination Sphere ◽  
High Efficiency ◽  
Light Emission ◽  
Critical Role ◽  
Organic Polymers ◽  
Blue Light Emission ◽  
Metal Organic

The role of Ga and Bi doping on the local structure of transparent zinc oxide thin films

2021 ◽  
pp. 159489
Author(s):  
Filipe C. Correia ◽  
Joana M. Ribeiro ◽  
Alexei Kuzmin ◽  
Inga Pudza ◽  
Aleksandr Kalinko ◽  
...  
Keyword(s):  
Thin Films ◽  
Zinc Oxide ◽  
Local Structure ◽  
Oxide Thin Films ◽  
Bi Doping

An effective and efficient approach to p-type AlN by Be2:O codoping from first-principles calculations

2016 ◽  
Vol 30 (20) ◽  
pp. 1650257
Author(s):  
Meng Zhao ◽  
Wenjun Wang ◽  
Jun Wang ◽  
Junwei Yang ◽  
Weijie Hu ◽  
...  
Keyword(s):  
First Principles ◽  
Ionization Energy ◽  
Hole Concentration ◽  
Valence Band Maximum ◽  
First Principles Calculations ◽  
Mutual Compensation ◽  
Efficient Approach ◽  
P Type ◽  
Codoping Method

Various Be:O-codoped AlN crystals have been investigated via first-principles calculations to evaluate the role of the different combinations in effectively and efficiently inducing p-type carriers. It is found that the O atom is favored to bond with two Be atoms. The formed Be2:O complexes decrease the acceptor ionization energy to 0.11 eV, which is 0.16 eV lower than that of an isolated Be in AlN, implying that the hole concentration could probably be increased by 2–3 orders of magnitude. The electronic structure of Be2:O-codoped AlN shows that the lower ionization energy can be attributed to the interaction between Be and O. The Be–O complexes, despite failing to induce p-type carriers for the mutual compensation of Be and O, introduce new occupied states on the valence-band maximum (VBM) and hence the energy needed for the transition of electrons to the acceptor level is reduced. Thus, the Be2:O codoping method is expected to be an effective and efficient approach to realizing p-type AlN.

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