nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
A density functional theory analysis of the mechanical and dynamic stability and thermodynamic properties of pyrite-type ZnSe2 and ZnTe2
|
Musari, A.A. |
|
2019 |
19 |
C |
p. |
artikel |
2 |
An optimized approach for computing coincidence-site-lattice grain boundary energy
|
Talaei, M.S. |
|
2019 |
19 |
C |
p. |
artikel |
3 |
DFT calculations of structural, optoelectronic and thermodynamic properties of BxAl1-xP alloys
|
Settouf, A. |
|
2019 |
19 |
C |
p. |
artikel |
4 |
Electronic, phonon transport and thermoelectric properties of Cs2InAgCl6 from first-principles study
|
Haque, Enamul |
|
2019 |
19 |
C |
p. |
artikel |
5 |
Electronic properties of silicon carbide nanotube with Stone Wales defects under uniaxial pressure: A computational study
|
Talla, Jamal A. |
|
2019 |
19 |
C |
p. |
artikel |
6 |
Erratum to “First-principles study of structural, electronic, magnetic and thermoelectric properties of the cubic mono-pnictides of thorium ThPn (Pn = Sb and Bi)” [Comput. Condens. Matter 13 (2017) 111–119]
|
Siddique, Muhammad |
|
2019 |
19 |
C |
p. |
artikel |
7 |
Ferromagnetism in Mn and Fe doped ZrO2 by ab-initio calculations
|
Goumrhar, F. |
|
2019 |
19 |
C |
p. |
artikel |
8 |
Ferromagnetism in p-block-element doped ZnO: An ab-initio approach
|
Luitel, Homnath |
|
2019 |
19 |
C |
p. |
artikel |
9 |
First-principles analysis of structural stability, electronic and phonon transport properties of lateral MoS2-WX2 heterostructures
|
Lawson, Matthew |
|
2019 |
19 |
C |
p. |
artikel |
10 |
First-principles investigation of elastic, transport, electronic and superconducting properties of noncentrosymmetric Re6 X (X=Zr, Hf)
|
Haque, Enamul |
|
2019 |
19 |
C |
p. |
artikel |
11 |
First-principles investigation of structural, electronic, optical and thermodynamic properties of KAg2SbS4
|
Berri, Saadi |
|
2019 |
19 |
C |
p. |
artikel |
12 |
First-principles study of half-metallic properties in X 2 VSi (X = Ti, Co) and their quaternary TiCoVSi and CoTiVSi compounds
|
Cheref, O. |
|
2019 |
19 |
C |
p. |
artikel |
13 |
First principle studies on structure, magneto-electronic and elastic properties of photovoltaic semiconductor halide (RbGeI3) and ferromagnetic half metal oxide (RbDyO3)
|
Parrey, Khursheed Ahmad |
|
2019 |
19 |
C |
p. |
artikel |
14 |
First principle study of structural, electronic, optical and electric properties of Ag2ZnGeX4(S, Se)
|
Nainaa, Fatima Zahra |
|
2019 |
19 |
C |
p. |
artikel |
15 |
First principle study of the structural, electronic, vibrational, thermodynamic, linear and nonlinear optical properties of zinc-blende ZnSe and ZnTe semiconductors
|
Asadi, Y. |
|
2019 |
19 |
C |
p. |
artikel |
16 |
Investigation of new d0 half-metallic full-heusler alloys N2BaX (X=Rb, Cs, Ca and Sr) using first-principle calculations
|
Benatmane, S. |
|
2019 |
19 |
C |
p. |
artikel |
17 |
Non-collinear magnetism in Mn monolayer on Ag(111) fcc: Density functional calculations
|
Malonda-Boungou, B.R. |
|
2019 |
19 |
C |
p. |
artikel |
18 |
Prediction of robustness of electronic, magnetic and thermoelectric properties under pressure and temperature variation in Co2MnAs alloy
|
Sofi, Shakeel Ahmad |
|
2019 |
19 |
C |
p. |
artikel |
19 |
Predictions of bandgap and subbands of γ−Al2O3 in presence of intrinsic point defects by DFT+TB-mBJ
|
Yazdanmehr, M. |
|
2019 |
19 |
C |
p. |
artikel |
20 |
Structural and thermodynamic properties of cubic sphalerite aluminum nitride under hydrostatic compression
|
Daoud, Salah |
|
2019 |
19 |
C |
p. |
artikel |
21 |
The first principle calculations of magnetic and thermoelectric properties of Ba2CeCoO6 with GGA and mBJ approximations
|
Besbes, Anissa |
|
2019 |
19 |
C |
p. |
artikel |
22 |
Theoretical studies on structural, electronic and optical properties of kesterite and stannite Cu2ZnGe(S/Se)4 solar cell absorbers
|
Gupta, Goutam Kumar |
|
2019 |
19 |
C |
p. |
artikel |