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Structural, electronic, magnetic, thermal and thermoelectrical properties of CdCu3Fe4O12 quadruple perovskite complex: an ab initio calculations
I. Ait Elkoua, R. Masrour
J. Korean Ceram. Soc. 2024;61(2):258-266.   Published online December 6, 2023
DOI: https://doi.org/10.1007/s43207-023-00340-2
      
First-principles calculations to investigate structural, optoelectronic and thermoelectric properties of Sn-based halide perovskites: CsSnCl3 and CH3NH3SnCl3
Y. Selmani, H. Labrim, L. Bahmad
J. Korean Ceram. Soc. 2024;61(1):189-200.   Published online November 8, 2023
DOI: https://doi.org/10.1007/s43207-023-00336-y
      
A DFT study of electronic structure and optical properties of the pure, doped and co-doped CaZrO3 perovskite for photovoltaic applications
A. El El Badraoui, S. Dahbi, N. Tahiri, O. El El Bounagui, H. Ez-Zahraouy
J. Korean Ceram. Soc. 2023;60(4):712-718.   Published online March 30, 2023
DOI: https://doi.org/10.1007/s43207-023-00297-2
         Cited By 1
Phase stability of double perovskite in Pr[Ba1−xSrx][Co1−yFey]2O5.5 using genetic algorithm and density functional theory
Jun-Yeong Jo, Hyun-Kyu Kim, Jason Kim, In-Gyu Choi, Yeong-Cheol Kim
J. Korean Ceram. Soc. 2023;60(2):434-439.   Published online December 21, 2022
DOI: https://doi.org/10.1007/s43207-022-00278-x
      
Study of the solar perovskites: XZnF3 (X= Ag, Li or Na) by DFT and TDDFT methods
S. Idrissi, O. Mounkachi, L. Bahmad, A. Benyoussef
J. Korean Ceram. Soc. 2023;60(2):424-433.   Published online January 17, 2023
DOI: https://doi.org/10.1007/s43207-022-00277-y
         Cited By 6
Analysis of ternary K3Cu3As2 compound for photovoltaic applications using density functional theory
Mwende Mbilo, Robinson Musembi
J. Korean Ceram. Soc. 2023;60(2):252-260.   Published online November 10, 2022
DOI: https://doi.org/10.1007/s43207-022-00259-0
         Cited By 1
Defect chemistry of p-type perovskite oxide La0.2Sr0.8FeO3-δ: a combined experimental and computational study
Hohan Bae, Yonghun Shin, Lakshya Mathur, Donghwa Lee, Sun-Ju Song
J. Korean Ceram. Soc. 2022;59(6):876-888.   Published online August 18, 2022
DOI: https://doi.org/10.1007/s43207-022-00237-6
         Cited By 7
A new design of SiO2–Na2O–Al2O3 glass–ceramic and determination of elastic modulus and density of states via molecular dynamics simulations based on density functional tight-binding calculations
Fatih Ahmet Celik
J. Korean Ceram. Soc. 2022;59(5):647-654.   Published online April 12, 2022
DOI: https://doi.org/10.1007/s43207-022-00201-4
         Cited By 1
The SrLiAl3N4:Eu2+ Phosphor Synthesized by the Raw Material Model Obtained by DFT Calculations
Woon Bae Park
J. Korean Ceram. Soc. 2017;54(3):217-221.   Published online May 31, 2017
DOI: https://doi.org/10.4191/kcers.2017.54.3.05
                        
Na-Ion Anode Based on Na(Li,Ti)O2 System: Effects of Mg Addition
Soo Hwa Kim, Dong-Sik Bae, Chang-Sam Kim, June Gunn Lee
J. Korean Ceram. Soc. 2016;53(3):282-287.   Published online May 31, 2016
DOI: https://doi.org/10.4191/kcers.2016.53.3.282
                        
Trends in Computational Materials Science Based on Density Functional Theory
June Gunn Lee
J. Korean Ceram. Soc. 2016;53(2):184-193.   Published online March 31, 2016
DOI: https://doi.org/10.4191/kcers.2016.53.2.184
                           Cited By 2
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