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Journal of the Korean Ceramic Society
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Structural, electronic, magnetic, thermal and thermoelectrical properties of CdCu
3
Fe
4
O
12
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: CsSnCl
3
and CH
3
NH
3
SnCl
3
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 CaZrO
3
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[Ba
1−
x
Sr
x
][Co
1−
y
Fe
y
]
2
O
5.5
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 TD
DFT
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 K
3
Cu
3
As
2
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 La
0.2
Sr
0.8
FeO
3-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 SiO
2
–Na
2
O–Al
2
O
3
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 SrLiAl
3
N
4
:Eu
2+
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)O
2
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
1
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Materials Science, Ceramics - Q1
Journal Impact Factor 2.5