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Computational Condensed Matter
Latest Publications
TOTAL DOCUMENTS
497
(FIVE YEARS 286)
H-INDEX
14
(FIVE YEARS 6)
Published By Elsevier
2352-2143
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Most Cited Documents
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Latest Documents
Most Cited Documents
Contributed Authors
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Ab initio predictions of structures and physical properties of the KCuX (X = Se and Te) phases under pressure
Computational Condensed Matter
◽
10.1016/j.cocom.2021.e00616
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2022
◽
Vol 30
◽
pp. e00616
Author(s):
M. Boualleg
◽
B. Bennecer
◽
F. Kalarasse
Keyword(s):
Physical Properties
◽
Ab Initio
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Performance comparison of hybrid functionals for describing narrow-gap semiconductors: A study on low-temperature thermoelectric material α-SrSi2
Computational Condensed Matter
◽
10.1016/j.cocom.2021.e00620
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2022
◽
Vol 30
◽
pp. e00620
Author(s):
Daishi Shiojiri
◽
Tsutomu Iida
◽
Masato Yamaguchi
◽
Naomi Hirayama
◽
Yoji Imai
Keyword(s):
Low Temperature
◽
Thermoelectric Material
◽
Performance Comparison
◽
Narrow Gap
◽
Narrow Gap Semiconductors
◽
Hybrid Functionals
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First-principles studies of electronic structure, magnetic and optical properties of rare-earth (RE= Sm, Eu, Gd, and Er) doped ZnS
Computational Condensed Matter
◽
10.1016/j.cocom.2021.e00632
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2022
◽
Vol 30
◽
pp. e00632
Author(s):
H. Hedjar
◽
S. Meskine
◽
A. Boukortt
◽
H. Bennacer
◽
M.R. Benzidane
Keyword(s):
Optical Properties
◽
Electronic Structure
◽
Rare Earth
◽
First Principles
◽
Er Doped
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Influence of Nitrogen and Boron on the magnetization of nanoporous graphene : A first-principle investigation
Computational Condensed Matter
◽
10.1016/j.cocom.2021.e00603
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2022
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pp. e00603
Author(s):
D.H. Douma
◽
L.T. Poaty
◽
F.B.S. Nkou
◽
P.S. Nianga-Obambi
◽
A.T. Raji
◽
...
Keyword(s):
First Principle
◽
Nanoporous Graphene
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Effects of nanostructures on the hydrogen storage properties of MgH2 - A first principles study
Computational Condensed Matter
◽
10.1016/j.cocom.2022.e00643
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2022
◽
pp. e00643
Author(s):
K. Iyakutti
◽
V.J. Surya
◽
R. Lavanya
◽
V. Vasu
◽
R. Rajeswarapalanichamy
◽
...
Keyword(s):
Hydrogen Storage
◽
First Principles
◽
Hydrogen Storage Properties
◽
First Principles Study
◽
Storage Properties
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Evaluation of structural, electronic, optical, elastic, and mechanical properties of triclinic Sn-doped Ga2O3 using density functional theory
Computational Condensed Matter
◽
10.1016/j.cocom.2022.e00641
◽
2022
◽
pp. e00641
Author(s):
Geoffrey Tse
Keyword(s):
Mechanical Properties
◽
Density Functional Theory
◽
Density Functional
◽
Functional Theory
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A first principles investigation on the structural, elastic, and mechanical properties of MAX phase M3AlC2 (M= Ta, Ti, V) as a function of pressure
Computational Condensed Matter
◽
10.1016/j.cocom.2021.e00638
◽
2022
◽
pp. e00638
Author(s):
Wutthigrai Sailuam
◽
Ittipon Fongkaew
◽
Sukit Limpijumnong
◽
Kanoknan Phacheerak
Keyword(s):
Mechanical Properties
◽
First Principles
◽
Max Phase
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Spin transport properties of boron nitride nanotubes: A DFT study
Computational Condensed Matter
◽
10.1016/j.cocom.2021.e00636
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2022
◽
pp. e00636
Author(s):
Sohrab Mohammadi
◽
Mehdi Taghizadeh
◽
Hasan Masoumi
Keyword(s):
Boron Nitride
◽
Transport Properties
◽
Spin Transport
◽
Boron Nitride Nanotubes
◽
Dft Study
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First-principles study of structural, electronic, elastic, and optical properties of the tetragonal AInS2 (A=K, Rb, Cs) chalcogenides
Computational Condensed Matter
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10.1016/j.cocom.2022.e00644
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2022
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pp. e00644
Author(s):
M. Bouchenafa
◽
Y. Bourourou
◽
A. Khelefhoum
◽
H. Boulebda
◽
M. Fadla
◽
...
Keyword(s):
Optical Properties
◽
First Principles
◽
First Principles Study
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Elastic, lattice dynamical, thermal, electronic, and optical properties of nano-semiconductor CdTe under the effect of temperature
Computational Condensed Matter
◽
10.1016/j.cocom.2022.e00640
◽
2022
◽
pp. e00640
Author(s):
Ibtisam F. Al Maaitah
◽
Elkenany Brens Elkenany
Keyword(s):
Optical Properties
◽
Effect Of Temperature
◽
Electronic And Optical Properties
◽
Elastic Lattice
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