Работы, на которые ссылается эта работа

Работ: 58

Работа: First-Principles Investigation of Structural, Electronic, Mechanical and Optical Properties of Tl Based Semiconducting Perovskites TlVX3 (X = Br, I) for Reflective Coating Applications

Ab‐initiosimulations of materials using VASP: Density‐functional theory and beyond
Jürgen Häfner
Статья2008Цитирований: 13
ABI
First-principles Phonon Calculations with Phonopy and Phono3py
Atsushi Togo
Статья2022Цитирований: 12
ABI
Investigation of structural, opto-electronic and thermoelectric properties of titanium based chloro-perovskites XTiCl3 (X = Rb, Cs): a first-principles calculations
Naimat Ullah Khan, Abdullah Abdullah, Umar Ayaz Khan +5
Статья2023Цитирований: 11
ABI
Insight into structural, electronic, optical and elastic properties of double perovskites Rb2XCrCl6 (X= K, Na) via DFT study
Abdullah Abdullah, Naimat Ullah Khan, Umar Ayaz Khan +8
Статья2023Цитирований: 8
ABI
Investigation on the electronic structure, optical, elastic, mechanical, thermodynamic and thermoelectric properties of wide band gap semiconductor double perovskite Ba2InTaO6
Sajad Ahmad Dar, Ramesh Sharma, Vipul Srivastava +1
Статья2019Цитирований: 7
ABI
Analysis of direct band gap A2ScInI6 (A=Rb, Cs) double perovskite halides using DFT approach for renewable energy devices
N.A. Noor, Muhammad Waqas Iqbal, Taharh Zelai +4
Статья2021Цитирований: 7
ABI
Non-empirical improvement of PBE and its hybrid PBE0 for general description of molecular properties
Jorge M. del Campo, José L. Gázquez, S. B. Trickey +1
Статья2012Цитирований: 7
ABI
Detail computational study about the structural, electronic, optical, and mechanical properties of RbVX3 (Cl, Br, I) halide perovskite materials
Naimat Ullah Khan, Javed Iqbal, Abdullah Abdullah +8
Статья2023Цитирований: 7
ABI
Probing the physical properties of Sr3AsX3 (X = F and Br) perovskite compounds for prospective solar cell applications employing the DFT framework
Ali Algahtani, Amina, Fida Rehman +8
СтатьяPerovskite Materials and ApplicationsInorganic Chemistry Communications2024Цитирований: 6
ABI
First-principles calculations to investigate structural, electronic, elastic, optical and transport properties of halide double perovskites Cs2ABF6 (AB = BiAu, AgIr, CuBi, GaAu, InAs, InAg, InAu, InSb and InBi) for solar cells and renewable energy applications
Saadi Berri
Статья2023Цитирований: 6
ABI
Multipiezo Effect in Altermagnetic V2SeTeO Monolayer
Yu Zhu, Taikang Chen, Yongchang Li +6
Статья2023Цитирований: 6
ABI
A DFT study of electronic, optical and thermoelectric properties of Ge-halide perovskites CsGeX3 (X=F, Cl and Br)
Soukaina Bouhmaidi, Adil Marjaoui, Abdelali Talbi +3
Статья2022Цитирований: 5
ABI
Thermoelectric properties of A2BCl6: A first principles study
Saadi Berri
Статья2022Цитирований: 4
ABI
Electronic Structural, Optical and Elastic Properties of K-Based Lead-Free Perovskites KXF3 (X = Nb, Ti, Zr) via DFT Computational Approach
Jehan Y. Al‐Humaidi, Abdullah Abdullah, Amina +7
СтатьяPerovskite Materials and ApplicationsJournal of Inorganic and Organometallic Polymers and Materials2023Цитирований: 4
ABI
Chemical Management for Colorful, Efficient, and Stable Inorganic–Organic Hybrid Nanostructured Solar Cells
Jun Hong Noh, Sang Hyuk Im, Jin Hyuck Heo +2
Статья2013Цитирований: 4
ABI
A comprehensive DFT analysis on structural, electronic, optical, thermoelectric, SLME properties of new Double Perovskite Oxide Pb2ScBiO6
Jisha Annie Abraham, Debidatta Behera, K. Bueala Kumari +3
Статья2022Цитирований: 4
ABI
Investigated the structural, optoelectronic, mechanical, and thermoelectric properties of Sr 2 BTaO 6 (B = Sb, Bi) for solar cell applications
Mumtaz Manzoor, Debidatta Bahera, Ramesh Sharma +3
Статья2022Цитирований: 4
ABI
Half-metallic and thermoelectric properties of Sr2EuReO6
Saadi Berri
Статья2021Цитирований: 3
ABI
First principle analysis of structural, electronic, optical, and thermoelectric characteristics of Ba3CaTa2O9 complex perovskite
Saadi Berri
Статья2022Цитирований: 3
ABI
First principle studies on structural, electronic, elastic, optical, and thermoelectric properties of <scp>XGeCl3</scp> (<scp>X = Rb/Cs</scp>): Promising compounds for green energy application
Debidatta Behera, M. Boudjelal, M. Batouche +3
Статья2024Цитирований: 3
ABI
A comprehensive DFT investigation of inorganic halide perovskites GaXCl3 (X = Ca, Sr, and Ba) for optoelectronics application
Md. Tanvir Hossain, Md Mehidi Hasan, Fatema-Tuz- Zahra +6
Статья2024Цитирований: 3
ABI
An extensive investigation of structural, electronic, and optical properties of inorganic perovskite Ca3AsCl3 for photovoltaic and optoelectronic applications: A first-principles approach using Quantum ATK tool
Krishna Kumar Mishra, Sonia Chahar, Rajnish Sharma
Статья2024Цитирований: 3
ABI
Optimizing novel perovskite Mg3AsBr3 through uniaxial stress: a comprehensive study of its potential in solar and optoelectronic applications
Sonia Chahar, Chakshu Malan, Krishna Kumar Mishra +1
Статья2024Цитирований: 3
ABI
Machine learned analysis of pnictides based Sr3PnCl3 (Pn = P, As, Sb) halide perovskites for next-generation solar applications
Krishna Kumar Mishra, Sonia Chahar, Rajnish Sharma
Статья2024Цитирований: 3
ABI
Investigation of the Double Perovskite Halides Cs2CuSbH6 (H = Cl, Br, I): Electronic and Optical Properties for Flexible Electronics Device Applications
Krishna Kumar Mishra
Статья2024Цитирований: 3
ABI

Работы, на которые ссылается эта работа

<i>Ab‐initio</i>simulations of materials using VASP: Density‐functional theory and beyond

First-principles Phonon Calculations with Phonopy and Phono3py

Investigation of structural, opto-electronic and thermoelectric properties of titanium based chloro-perovskites XTiCl<sub>3</sub> (X = Rb, Cs): a first-principles calculations

Insight into structural, electronic, optical and elastic properties of double perovskites Rb2XCrCl6 (X= K, Na) via DFT study

Investigation on the electronic structure, optical, elastic, mechanical, thermodynamic and thermoelectric properties of wide band gap semiconductor double perovskite Ba<sub>2</sub>InTaO<sub>6</sub>

Analysis of direct band gap A2ScInI6 (A=Rb, Cs) double perovskite halides using DFT approach for renewable energy devices

Non-empirical improvement of PBE and its hybrid PBE0 for general description of molecular properties

Detail computational study about the structural, electronic, optical, and mechanical properties of RbVX<sub>3</sub> (Cl, Br, I) halide perovskite materials

Probing the physical properties of Sr3AsX3 (X = F and Br) perovskite compounds for prospective solar cell applications employing the DFT framework

First-principles calculations to investigate structural, electronic, elastic, optical and transport properties of halide double perovskites Cs2ABF6 (AB = BiAu, AgIr, CuBi, GaAu, InAs, InAg, InAu, InSb and InBi) for solar cells and renewable energy applications

Multipiezo Effect in Altermagnetic V<sub>2</sub>SeTeO Monolayer

A DFT study of electronic, optical and thermoelectric properties of Ge-halide perovskites CsGeX3 (X=F, Cl and Br)

Thermoelectric properties of A2BCl6: A first principles study

Electronic Structural, Optical and Elastic Properties of K-Based Lead-Free Perovskites KXF3 (X = Nb, Ti, Zr) via DFT Computational Approach

Chemical Management for Colorful, Efficient, and Stable Inorganic–Organic Hybrid Nanostructured Solar Cells

A comprehensive DFT analysis on structural, electronic, optical, thermoelectric, SLME properties of new Double Perovskite Oxide Pb2ScBiO6

Investigated the structural, optoelectronic, mechanical, and thermoelectric properties of Sr <sub>2</sub> BTaO <sub>6</sub> (B = Sb, Bi) for solar cell applications

Half-metallic and thermoelectric properties of Sr2EuReO6

First principle analysis of structural, electronic, optical, and thermoelectric characteristics of Ba3CaTa2O9 complex perovskite

First principle studies on structural, electronic, elastic, optical, and thermoelectric properties of <scp>XGeCl<sub>3</sub></scp> (<scp>X = Rb/Cs</scp>): Promising compounds for green energy application

A comprehensive DFT investigation of inorganic halide perovskites GaXCl3 (X = Ca, Sr, and Ba) for optoelectronics application

An extensive investigation of structural, electronic, and optical properties of inorganic perovskite Ca3AsCl3 for photovoltaic and optoelectronic applications: A first-principles approach using Quantum ATK tool

Optimizing novel perovskite Mg<sub>3</sub>AsBr<sub>3</sub> through uniaxial stress: a comprehensive study of its potential in solar and optoelectronic applications

Machine learned analysis of pnictides based Sr3PnCl3 (Pn = P, As, Sb) halide perovskites for next-generation solar applications

Investigation of the Double Perovskite Halides Cs2CuSbH6 (H = Cl, Br, I): Electronic and Optical Properties for Flexible Electronics Device Applications