Debidatta Behera - Publications, H-index & Citations

Debidatta Behera

kalinga institute of social sciences

31H指数

66论文数

2.2K被引数

收录论文 22

发表时间

Spin-resolved electronic structure and thermoelectric performance of A₂RuBr₆ (A = Cs, Rb) double perovskites 自旋分辨电子结构与A₂RuBr₆（A = Cs, Rb）双钙钛矿的热电性能

Inorganic Chemistry Communications

IF5.4

2026-09-18

PREAI

Debidatta Behera; A. Amar; H. Rozale; Kalpana Sahoo; Sanat Kumar Mukherjee

Structural, electronic, mechanical, and optical properties of SnSiO3 and PbSiO3 Perovskites: A first-principles insight into silicon-based oxide optoelectronic materials SnSiO3和PbSiO3钙钛矿的结构、电子、力学和光学性质：基于第一性原理的硅基氧化物光电子材料研究

Computational Condensed Matter

IF3.9

2026-04-07

PREAI

Tesfaye Abebe Geleta; Kaneez Fatima; Tamiru Deressa Morka; Kuo-Long Pan; Debidatta Behera

Structural and optical properties of CuO: A comprehensive experimental and first-principles DFT Investigation CuO的结构和光学性质：综合实验与第一性原理DFT研究

Solid State Communications

IF2.4

2026-02-01

PREAI

Deo, Rituparna; Devi, Maya; Behera, Debidatta

Pioneering computational insights into KZrS3 and KZrSe3 for future optoelectronics 对KZrS3和KZrSe3未来光电子学的前沿计算见解

Phase Transitions

IF1.4

2026-01-01

PREAI

Dash, Sudipta; Behera, Debidatta; Mohanty, Sangram Kishore; Palai, Gopinath; Mohanty, Subhashree

Re-designing lead-free halide perovskite RbSnF₃: structural and electronic band gap modifications induced by Indium doping using density functional theory 重新设计无铅卤化物钙钛矿RbSnF₃：利用密度泛函理论研究铟掺杂引起的结构和电子带隙改性

Optical and Quantum Electronics

IF4

2025-07-29

OAAI

Merve Özcan; Debidatta Behera; Aiswarya Priyambada; Sanat Kumar Mukherjee

Tailoring the structural; elastic Electronic and optical properties of of TiO₂ via Carbon Doping: A First-Principles Study 通过碳掺杂调控TiO₂的结构、弹性、电子和光学性质：一项第一性原理研究

New J. Chem.

IF2.5

2025-07-22

PREAI

Prakash Kumar Moharana; Debidatta Behera; Rituparna Deo; Maya Devi; Bidhubhusan Sahu; Sanat Kumar Mukherjee

Numerical analysis of photovoltaic performance in NaSnCl3 and KSnCl3 perovskite absorber layers for solar energy harvesting: SCAPS-1D study

MATERIALS TODAY COMMUNICATIONS

IF4.5

2024-08-01

PREAI

Bouri, Nabil; Geleta, Tesfaye Abebe; Guji, Kefyalew Wagari; Behera, D.; Nouneh, Khalid

First principles insight into the study of the structural, stability, and optoelectronic properties of alkali-based single halide perovskite ZSnCl3 (Z = Na/K) materials for photovoltaic applications

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2024-07-15

PREAI

Geleta, Tesfaye Abebe; Behera, Debidatta; Bouri, Nabil; Rivera, Victor Jose Ramirez; Gonzalo, Fredy Mamani

A DFT insight into the physical features of alkaline based perovskite compounds AInBr 3 (A = K, Rb)

SOLID STATE IONICS

IF3.3

2024-06-01

PREAI

Behera, Debidatta; Lawati, Dhan Raj; Agouri, M.; Abbassi, A.; Taj, S.; Manaut, B.; Mukherjee, Sanat Kumar

Comprehensive first principles to investigate optoelectronic and transport phenomenon of lead-free double perovskites Ba2 AsBO6 (B=Nb, Ta) compounds 综合第一性原理研究无铅双钙钛矿Ba2 AsBO6 (B = Nb，Ta) 化合物的光电和输运现象

HELIYON

IF3.6

2024-05-01

OAAI

Manzoor, Mumtaz; Behera, Debidatta; Sharma, Ramesh; Moayad, A. J. A.; Al-Kahtani, Abdullah A.; Kumar, Yedluri Anil

Prediction of new MAX phase Zr2MSiC2 (M = Ti, V) compounds as a promising candidate for future engineering: DFT calculations

MATERIALS SCIENCE AND ENGINEERING B-ADVANCED FUNCTIONAL SOLID-STATE MATERIALS

IF4.6

2024-03-01

PREAI

Behera, D.; Dixit, Aparna; Azzouz-Rached, Ahmed; Bentouaf, Ali; Rahman, Md. Ferdous; Albalawi, Hind; Bouhenna, Abdessalem; Yousef, El Sayed; Sharma, Ramesh

First principles studies on optoelectronics and transport properties of KSrY (Y = Sb, Bi) for renewable energy application 用于可再生能源应用的KSrY (Y = Sb，Bi) 的光电和输运性质的第一性原理研究

MATERIALS SCIENCE AND ENGINEERING B-ADVANCED FUNCTIONAL SOLID-STATE MATERIALS

IF4.6

2023-11-01

PREAI

Behera, Debidatta; Al-Qaisi, Samah; Manzoor, Mumtaz; Sharma, Ramesh; Srivastava, Vipul; Al-Anazy, Murefah mana; El Shiekh, E.; Mukherjee, Sanat Kumar

Structural, electronic, optical, and thermoelectric studies on Zintl SrCd2Pn2 (Pn=P/As) compounds for solar cell applications: A First Principle Approach

JOURNAL OF SOLID STATE CHEMISTRY

IF3.5

2023-10-01

PREAI

Manzoor, Mumtaz; Behera, Debidatta; Sharma, Ramesh; Iqbal, Muhammad Waqas; Mukherjee, S. K.; Khenata, R.; Bin-Omran, S.; Alshahrani, Thamraa; El Shiekh, E.; Ouahrani, T.

Study of mechanical, optical, and thermoelectric characteristics of Ba2XMoO6 (X = Zn, Cd) double perovskite for energy harvesting

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2023-08-21

PREAI

Al-Qaisi, Samah; Rached, Habib; Alrebdi, Tahani A. A.; Bouzgarrou, S.; Behera, Debidatta; Mukherjee, Sanat Kumar; Khuili, Mohamed; Adam, Mohamed; Verma, Ajay Singh; Ezzeldien, Mohammed

Vibrational, mechanical, electronic and thermodynamic properties of rhenium-based perovskites XReO3(X = Li, Be) by an ab-initio computation

MATERIALS SCIENCE AND ENGINEERING B-ADVANCED FUNCTIONAL SOLID-STATE MATERIALS

IF4.6

2023-08-01

PREAI

Dixit, Aparna; Behera, Debidatta; Tripathi, Santosh Kumar; Srivastava, Anshuman; Sharma, Ramesh; Khenata, R.; Albalawi, Hind; Mahmoud, Z.; Mukherjee, Sanat Kumar

Theoretical insight on the electronic band structure, mechanical, vibrational and thermodynamic characteristic of antiperovskites RE3InN (RE=Y and La)关于反钙钛矿RE3InN (RE = Y和La) 的电子能带结构，机械，振动和热力学特性的理论见解

MATERIALS TODAY COMMUNICATIONS

IF4.5

2023-06-01

PREAI

Behera, Debidatta; Dixit, Aparna; Nahak, Binayaka; Srivastava, Anshuman; Sharma, Ramesh; Khenata, R.; Bin-Omran, S.; Abdelmohsen, Shaimaa A. M.; Abdelbacki, Ashraf M. M.; Mukherjee, Sanat Kumar

First-principles calculations to investigate structural, optoelectronics and thermoelectric properties of lead free Cs2GeSnX6 (X = Cl, Br)

MATERIALS SCIENCE AND ENGINEERING B-ADVANCED FUNCTIONAL SOLID-STATE MATERIALS

IF4.6

2023-06-01

PREAI

Behera, Debidatta; Mukherjee, Sanat Kumar

Impact of hole transport material on perovskite solar cells with different metal electrode: A SCAPS-1D simulation insight 空穴传输材料对不同金属电极钙钛矿太阳能电池影响的SCAPS-1D模拟研究

HELIYON

IF3.6

2023-06-01

OAAI

Danladi, Eli; Gyuk, Philibus M.; Tasie, Nicholas N.; Egbugha, Anselem C.; Behera, Debidatta; Hossain, Ismail; Bagudo, Ibrahim M.; Madugu, Mohammad L.; Ikyumbur, Jonathan T.

First principles insights on the structural, mechanical, dynamical, thermoelectric and thermodynamics properties of novel topological (ScSb) semi-metal

MATERIALS SCIENCE AND ENGINEERING B-ADVANCED FUNCTIONAL SOLID-STATE MATERIALS

IF4.6

2023-05-01

PREAI

Manzoor, Mumtaz; Behera, Debidatta; Sharma, Ramesh; Iqbal, Muhammad Waqas; Mukherjee, S. K.

First principles insight on structural, opto-electronic and transport properties of novel zintl-phase AMg2Bi2 (A=Sr, Ba)

JOURNAL OF SOLID STATE CHEMISTRY

IF3.5

2023-04-01

PREAI

Behera, Debidatta; Manzoor, Mumtaz; Sharma, Ramesh; Iqbal, Muhammad Waqas; Mukherjee, Sanat Kumar

研究方向