Aourag Group Published Papers, Monographs, and Symposia

1989 1990 1991 1992 1993 1994 1995 1996 1997 1998 1999 2000 2001 2002 2003 2004 2005 2006 2007 2008

In Preparation

Designing Superlattices Ultra Hard Coatings: Datamining Approach
H.Aourag, F. Saidi, T. Sahraoui, S. Broadrick, and K. Rajan
Optimizing the Mechanical Properties of hardenable 7xxx Aluminum Alloys
K. Benyelloul, T. Sahraoui¹, G. Merad and H. Aourag
Detecting Crystallographic Clustering via Pattern Recognition Techniques of DOS Curves
Scott R. Broderick, Hafid Aourag, Krishna Rajan

Data-Mining the Empirical Pseudopotential Method
H. Zenasli, H. Aourag, and K. Rajan

Submitted

1) Data Mining Density of States Spectra for Crystal Structure Classification: An Inverse Problem Approach
Scott R. Broderick, Hafid Aourag, Krishna Rajan, Statistical Analysis and Data Mining Journal- Special issue: Materials Informatics

2) The Electronic Structure of PbCl2, PbBr2 and their alloys Revisited
H. Aourag*, H. Faraoun, G. Merad and M. Certier1, Phys. Stat. Sol (b)

3) Principal Component Analysis for Descriptor Development towards Alloy Design

S.R. Broderick, H. Aourag, K. Rajan, Phys Rev B

1989

1) H.Aourag, R.N.West, J.H.Kaiser and T.Kobayasi

Positron Annihilation in semiconductors

Positron Annihilation (World Scientific, Singapore, 1989), p680

2) H.Aourag, A.Belaidi, T.Kobayasi, R.N.West and B.Khelifa

Positron annihilation in Si and Ge

Phys.Stat.Sol. (b) 155 (1989) 191

3) H.Aourag, A.Belaidi and B.Khelifa

Correlation between the high pressure properties and charge density in Si and Ge

Mater. Chem. Phys. 24 (1989) 209

4) H.Aourag, A.Belaidi, T.Kobayasi, R.N.West and B.Khelifa

Electron and positron distribution for the plane (110) in Si and GaAs

Phys.Stat.Sol. (b) 156 (1989) 497

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1990

5) A.Belaidi, R.N.West, H.Aourag and B.Khelifa

Phase transition effects on the Mg-Cd system on the positron annihilation parameters

J.Phys : Condensed Matter 2 (1990) 2229

6) H.Aourag, B.Khelifa, A.Belaidi, A.Tadjer, M.Rezki, and M.Gamoudi

Positron band structures of GaAs and CdTe

Phys.Stat.Sol. (b) 160 (1990) 193

7) H.Aourag, B.Khelifa, A.Belaidi and T.Kobayasi

Interpretation of the group theoretical unexpected shape of the contour appearing in the LCW data for Si and Ge

Phys.Stat.Sol. (b) 160 (1990) 561

8) H.Aourag, A.Belaidi, B.Khelifa, L.Hamerlaine and H.Belarbi

Conduction band edge charge densities in II-VI compound semiconductors

Phys.Lett. A 155 (1990) 455

9) A.Belaidi, H.Aourag and B.Khelifa

Positron trapping in Au

Mater.Chem.Phys. 25 (1990) 523

10) H.Aourag, A.Belaidi and B.Khelifa

Valence and Conduction band edges for SiC and BN

Mater. Chem. Phys. 25 (1990) 531

11) H.Aourag, B.Khelifa, A.Belaidi and Z.Belarbi

Positron distribution in semiconductors

Phys. Stat. Sol. (b) 160 (1990) 201

12) H.Aourag, A.Belaidi, B.Khelifa, M. Gamoudi and C.Jardin

The correlation between the charge densities and interstitial impurities in AlP and AlAs

Phys.Lett. A 149 (1990) 305

13) H.Aourag, B.Khelifa and A.Belaidi

Positron charge distribution in Al

Phys. Stat. Sol. (b) 162 (1990) K43

14) H.Aourag, B.Soudini, B.Khelifa and A.Belaidi

Electron and positron distribution in grey tin

Phys. Stat.Sol. (b) 161 (1990) 685

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1991

15) H.Aourag, B.Khelifa, A.Bounoua and M.Hammadi

Semiconductors positron band structures

Phys. Stat. Sol. (b) 164 (1991) K77

16) H.Aourag and B.Khelifa

Positron Affinity in III-V semiconductors

Mater. Chem. Phys. 27 (1991) 61

17) Z.Belarbi, G.Guilaud, F.Tournihlac, H.Aourag and B.Khelifa

Dielectric properties of two polar nematic liquid crystals

Jap. Journal. Appl. Phys. 30 (1991) 711

18) H.Aourag, B.Khelifa, F.Sellal and A.Mahmoudi

Electronic structure of Si as function of lattice constant

Mater. Chem. Phys. 28 (1991) 331

19) H.Aourag, G.Merad, B.Khelifa and A.Mahmoudi

Valence and conduction band edges in diamond

Mater. Chem. Phys. 28 (1991) 431

20) H.Aourag, B.Khelifa, A.Belaidi, A.Tadjer, M.Rezki and M. Gamoudi

Conduction band edges densities in GaAlSb

Phil. Mag. B 63 (1991) 1267

21) B.Soudini, H.Aourag and B.Khelifa

The effects of lattice constant variation on elelctron and positron charge densities in grey tin

Phys. Stat. Sol. (b) 167 (1991) 139

22) A.Belaidi, H.P. Leighly Jr, H.Aourag, B.Khelifa, M. Oubadi and A.Elias

Mater. Chem. Phys. 30 (1991) 135

23) H.Aourag, B.Khelifa, M.Rezki and A.Tadjer

Conduction band edge densities in HgCdTe

24) A.Belaidi, H.Aourag, B.Khelifa, M.Elias and M.Oubadi

Positron trapping in some metals

Mater. Chem. Phys. 27 (1991) 55

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1992

25) H.Aourag , G.Merad, K.Ghaffour, H.Abid, N.Badi and B.Khelifa

The high pressure behaviour in InSb and b-SiC

Comp. Mater. Sci. 1 (1992) 78

26) G.Merad, H.Aourag and B.Khelifa

Valence and conduction band edges charge densities in GaInAs

Mater. Chem. Phys. 30 (1992) 187

27) H.Aourag, F.Sellal, and B.Khelifa

The variation of valence and conduction band edges with lattice constant in GaP and InP

Mater. Chem. Phys. 30 (1992) 229

28) H.Aourag, M. Hammadi, M.Mahmoudi and B. Khelifa

The electron pseudo charge densities in Zn HgTe

Mater.Chem.Phys. 31 (1992) 359

29) G.Merad, H.Aourag and B.Khelifa

The valence and conduction band edge densities under pressure for GaSb

Physica. Scripta 45 (1992) 454

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1993

30) M.Gamoudi, O.Beqqali, G.Guillaud, B.Khelifa and H.Aourag

Chain length and electrical conductivity in polyacetylene

J.Phys. III France 3 (1993) 167

31) H.Aourag, F.Sellal, H.Abid, N.Badi, A.Mahmoudi and B.Khelifa

The high pressure behaviour of AlSb

Mater. Chem. Phys. 33( 1993) 254

32) H.Aourag, M.Hammadi and B.Khelifa

Correlation between substitution and interstial doping in ZnHgTe

Mater. Chem. Phys. 33 (1993) 197

33) M.Ferhat, H.Aourag and B.Khelifa

Correlation between high pressure effect and alloyong in GaAs

Comp. Mater. Sci. 1 (1993) 369

34) B.Soudini, H.Aourag , N.Amrane, M.Gamoudi and B.Khelifa

Pressure dependence of positron annihilation in InP

Comp. Mater. Sci. 1 (1993) 373

35) H.Aourag , M.Driz, B.Khelifa, H.Nara and T.Kobayasi

The weakness of the adjustment of the pseudopotential form factors

Mater. Chem. Phys. 36 (1993) 77

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1994

36) B.Soudini , H.Aourag, N.Amrane, M.Sehil, Z.Boussahla, F.Sellal, B.Khelifa and A.Mahmoudi

Positron affinity of GaInAs as function of the mole fraction

Mater. Chem Phys. 36 (1994) 271

37) A.Mahmoudi, B.Soudini, N.Amrane, H.Aourag and B.Khelifa

Conduction band edges charge densities in CdZnS

Comp. Mater. Sci. 2 (1994) 213

38) H.Abid, N.Badi, B.Soudini, N.Amrane, M.Driz, M.Hammadi, H.Aourag and B.Khelifa

Pressure dependence of band gaps in GaAs, GaP, InP and InAs

Mater. Chem. Phys. 36 (1994) 217

39) M.Driz, H.Aourag, H.Abid, B.Khelifa and N.Badi

The pseudobinary alloy (Ga,As)Al under hydrostatic pressure

Mater. Sci. Eng. (B) 25 (1994) 159

40) F. Benkabou, H. Aourag, J.P. Dufour, T. Kobayasi, H. Nara and B. Khelifa

Pressure dependence of the band gaps and charge densities in Si.

Phys. Stat. Sol. (b) 182 (1994) 109.

41 M. Ferhat, A. Zaoui, B. Khelifa and H. Aourag

Band structures calculations of Ge_xSi_1-x.

Solid State Commun. 91 (1994) 287.

42) M. Driz, N. Badi, B. Soudini, N. Amrane H. Abid, N. Bouarissa, B. Khelifa and H. Aourag

The alloying and pressure dependence of band gaps in GaAs and GaAs_xP_1-x.

Comp. Mater. Sci. 2 (1994) 287.

43) N. Badi, H. Abid, B. Soudini, N. Amrane, M. Hammadi, M. Driz, B. Khelifa and H. Aourag

Band structure of Ga_1-xAl_xP under a uniaxial stress.

Comp. Mater. Sci. 3 (1994) 50.

44) N. Badi, H. Abid, B. Soudini, N. Amrane, H. Aourag and B. Khelifa

Valence and conduction band-edges-charge densities in Ga_1-xAl_xP mixed crystals.

Mater. Chem. Phys. 38 (1994) 243.

45) H. Aourag, F. Benkabou, B. Abbar, S. Ait-Abderahmane, J.P. Dufour and B. Khelifa

Pressure dependence of positron distribution in Si

Mater. Chem. Phys. 38 (1994) 243.

46) F. Benkabou, J.P. Dufour, B. Soudini, N. Amrane, B. Khelifa and H. Aourag

Pressure dependence of positron annihilation in Si.

Phys. Stat. Sol. (b) 184 (1994) 355.

47) F. Driss-Khodja, H. Abid, N. Badi, B. Soudini, N. Amrane, M. Driz, B. Khelifa and H. Aourag

Electronic structure of pseudobinary semiconductor alloys Ga_xAl_1-xSb.

Mater. Sci. and Eng. (B) 27 (1994) 93.

48) A. Zaoui, M. Ferhat, B. Khelifa, J.P. Dufour and H. Aourag

Correlation between the ionicity character and the charge density in semiconductors

Phys. Stat. Sol. (b) 185 (1994) 163.

49) N. Badi, H. Abid, B. Soudini, N. Amrane, M. Driz, J.P. Dufour, H. Aourag and B. Khelifa

The uniaxial strain effect on the Ternary alloy semiconduxtor GaAlP

Phys. Stat. Sol. (b) 184 (1994) 365.

50) H. Aourag, B. Djellouli, A. Hazzab and B. Khelifa

Electronic structure of SiC under pressure

Mater. Chem. Phys. 39 (1994) 34.

51) N. Badi, H. Abid, M. Driz, N. Amrane, B. Soudini, B. Khelifa and H. Aourag

Electronic structure of BP

Phys. Stat. Sol. (b) 186 (1994) 379.

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1995

52) M. Ferhat, B. Khelifa, A. Zaoui, N. Bouarissa, B. Bouhafs, J.P. Dufour and H. Aourag

Band structures calculations of GaAs_1-xP_x.

Comp. Mater. Sci. 3 (1995) 393.

53) S. Khafadji, N. Amrane, N. Bouarissa, N. Badi, B. Soudini, M. Sehil and H. Aourag

Pressure dependence of electron and positron band structures in elemental semiconductors

Phys. Stat. Sol. (b) 189 (1995) 139.

54) H. Aourag, S. Ait Abderahmane, Na. Amrane, N. Amrane, and N. Bouarissa

Electronic and positronic structure of diamond under normal and high pressure

Phys. Stat. Sol. (b) 189 (1995) 417.

55) A. Zaoui, M. Ferhat, B. Bouhafs and H. Aourag

Prediction of high pressure phase transition in Al compounds by the ionicity charater

Phys. Stat. Sol. (b) 189 (1995) K5.

56) B. Bouhafs, M. Ferhat, N. Amrane, B. Khelifa and H. Aourag

Predicted modification of band gaps in GaP

Infra-Red Physics and technology. 36 (1995) 791.

57) H. Kalai, B. Khelifa, N. Badi, H. Abid, N. Amrane, B. Soudini, and H. Aourag

Correlation between pressure effect and alloying in AlGaP

Mater. Chem. Phys. 39 (1995) 180.

58) Na. Amrane, S. Ait Abderahmane and H. Aourag

Energy band structure calculation of GeSn and SiSn

Infra-Red Physics and technology. 36 (1995) 843.

59) N. Bouarissa and H. Aourag

Electronic structure of GaInAs and InAsSb alloys

Infra-Red Physics and technology. 36 (1995) 755.

60) N. Bouarissa and H. Aourag

Conduction band edges charge densities in InGaSb

Phys. Stat.Sol (b) 190 (1995) 227.

61) N. Bouarissa , R.N; West and H. Aourag

Positron annihilation in Narrow gap semiconductor

Phys. Stat.Sol (b) 188 (1995) 723.

62) H. Abid, N. Badi, M. Driz, N. Bouarissa, K. Benkabou, B. Khelifa and H. Aourag

Electronic structure of quaternary alloys GaInAsP

Mat. Sci. Eng. (b) 33 (1995) 133.

63) N. Bouarissa and H. Aourag

Theoretical investigation of the pressure dependences of band gaps in InAs and InSb

Mat. Sci. Eng. (b) 33 (1995) 122.

64) N. Bouarissa and H. Aourag

Band strcture of alloys under pressure

Infrared. Physics and Technology. 36 (1995) 973.

65) H. Abid, N. Badi, M. Driz, N. Bouarissa, K. Benkabou, B. Khelifa and H. Aourag

Electronic structure of the quaternary alloy GaInAsP

Mat. Sci. Eng. (b) 33 (1995) 133.

66) N. Bouarissa, A. Tonto, H. Aourag and T. Bent-Meziane

Pressure dependence of the electronic structure in germanium

Comp. Mater. Sci. 3 (1995) 430.

67) B.. Bouhafs, F. Benkabou, J.P. Dufour, B. Khelifa and H. Aourag

Energy band structure calculations in Si_xSn_1-x and Ge_xSn_1-x.

Infrared. Physics and Technology. 36 (1995) 967.

68) N. Bouarissa and H. Aourag

Positron energy levels in narrow gap semiconductors

Mat. Sci. Eng. (b) 34 (1995) 58.

69) N. Sekkal, H. Aourag, N. Amrane, B. Soudini

Resonant Tunneling effect through parabolic quantum well

Physica B. 215 (1995) 171.

70) N. Bouarissa, T. Kobayasi, H. Nara and H. Aourag

Pressure depndence of positron annihilation in Germanium

Solid State. Commun. 96 (1995) 689.

71) H. Aourag and B. Bouhafs

Predicted modificarions of the direct-indirect band gap in Si

Solid State. Commun. 96 (1995) 245.

72) B. Soudini, N. Amrane, N. Badi, B. Khelifa and H. Aourag

Positron annihilation in Ga_xIn_1-xAs

Solid State. Commun. 96 (1995) 987.

73) M. Soltani, M. Certier, P. Becker, H. Aourag and B. Khelifa

Application of the dead-layer model and A.B.C.Conditions to the Z12 and Z3 exciton lines in CuCl

Comp. Mater. Sci. 4 (1995) 263.

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1996

74) N. Sekkal, N. Amrane, B. Abbar and H. Aourag

Parabolic quantum wells of AlGaAs

Infrared. Physics and Technology. 37 (1996) 489

75) H. Aourag, B. Abbar, N. Bouarissa, J.P. Dufour

Positron work function in elemental semiconductor

Matter. Chem. Phys.36 (1996) 221.

76) H. Aourag

Positron density of states in elemental semiconductor

Matter. Chem. Phys. 48 (1996) 21.

77) N. Bouarissa, R.N. West and H. Aourag

Positron annihilation in alloys under pressure

Matter. Chem. Phys. 49 (1996) 210.

78) N. Bouarissa and H. Aourag

The effect of disorder on the positron levels in InGaSb

Solid State.Commun. 101 (1996) 205.

79) Na Amrane, B.Soudini, N.Amrane and H.Aourag

Positron Annihilation in diamond

Mater. Sci. Eng. (B) 40 (1996) 119

80) N. Badi, A. Boucetta, A. Bensaoula and H. Aourag

Dynamical Charge anf force constants in c-BN under pressure

Phys. Stat.Sol. (b) 198 (1996) 721

81) M. Ferhat, B. Bouhafs, A. Zaoui, M. Certier, B. Khelifa and H. Aourag

Electonic structure of AlGa and GaSb alloys : modified virtual crystal approximation using sp3s* band structure

Mater. Sci. and Eng. (B) 41 (1996) 304.

82) A.Zaoui, H.Aourag, M.Certier and B.Khelifa

Optical Properties of GeSn

J.Infrared.Phys. 37 (1996) 483

83) H.Abid, M.Rezki and H.Aourag

Electronic Structure and Optical Properties of the Quaternary Alloys GaAlAsSb

Mat.Sci.Eng. B 41 (1996) 314

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1997

84) N.Bouarissa and H.Aourag

Energy Gap versus alloy compositon and temperature in GaInSb

Phys.Stat.Sol (b) 199 (1997) 403

85) H. Aourag ,B. Bouhafs and M.Certier

Empirical Pseudopotential calculations in GaAsN ans AlAsN ordered alloys

Phys.Stat.Sol (b) 201 (1997) 117.

86)W. Sekkal, A. Krallafa and H. Aourag

Atomistic Simulation of the Structural, Elastic and Thermodynamic Properties of Fullerite

Phys. Stat.Sol. (b) 201 (1997) 355.

87) H.Aourag and M.Certier

Positron Annihilation in CuCl

Phys.Stat.Sol (b) 202 (1997) 951

88) R.Moussa, J.P.Dufour and H.Aourag

Photonic Band Gap in Two and Three Dimensional periodic structure

Physica Status Solidi B. 204 (1997) 661

89)A.Zaoui, M.Ferhat, M.Certier, H.Aourag and B.Khelifa

Calculation of the elastic properties of CuCl

Phys. Lett. A 228 (1997) 378

90) N.Bouarissa and H.Aourag

The temperature dependence of the band gaps in narrow gap semiconductors

Infrared Phys. Tech. 38 (1997) 153

91) H.Aourag

Electron and positron energy distributions in silicon

Mater.Chem.Phys. 48 (1997) 21

92) N.Bouarissa and H.Aourag

The disorder effect on the electron and positron

Solid.State.Commun. 101 (1997) 205

93) N.Bouarissa, H.Aourag and J.P.Dufour

Temperature effect in GaSb

Mater.Sci.Eng B 47 (1997) 1

94)N.Bouarissa, R.N.West and H.Aourag

Theoretical investigation of the pressure dependences of positron annihilation in InAs and InSb

Mater.Chem.Phys. 47 (1997) 23

95) N; Bouarissa and H. Aourag

Disorder effect on positron annihilation in GaAlAs

Phil.Mag. B 75 (1997) 325.

96) H. Abid, M. Rezki and H. Aourag

Pressure dependence of band gaps in CdTe

Mater. Sci. And Eng (B) 49(1997) 213.

97) Theoretical Analysis of Disorder Effects on electronic and Optical Properties in Quaternary Alloys.

B.Bouhafs, M.Ferhat, M.Certier and H.Aourag

J. Appl.Phys. 82 (1997) 4923

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1998

98) W.Sekkal, M.Certier and H.Aourag

Molecular Dynamics of Uniaxial and Hydrostatic Compression of C₇₀ in the Disorder Phase

Comp. Mat.Sci. 9 (1998) 295

99) A.Zaoui, M.Certier, M.Ferhat, O.Pages and H.Aourag

Disorder Effect on Optical properties of ZnSeTe

J.Cryst.Growth 184 (1998) 1090

100) A.Zaoui, M.Certier , M.Ferhat and H.Aourag

Lattice and Electronic Structure Properties of (AlN)x(SiC)1-x

Phys.Stat.Sol. (b) 205 (1998) 587

101) B.Bouhafs, H.Heireche, W.Sekkal,M.Certier, and H.Aourag

Electronic and optical properties of copper halides mixed crystals CuClI

Phys. Lett. A 240 (1998) 257

102) Z. Bousahla,B. Abbar, B. Belgoumene, and H. Aourag

Positron deformation potential and diffusion constant in Inp.

J. Physics and Chemistry of Solids 59 (1998) 1133

103) B.Bouhafs, M.Ferhat, M.Certier and H.Aourag

Pressure dependence of electronic properties in zinc-blende -like SiGe compounds

J.Physics and Chemistry of Solids 59 (1998) 759

104) H.Aourag and M.Certier

Electronic Structure Studies in Semiconductors Nitrides

J.Physics and Chemistry of Solids 59 (1998) 1145

105)F.Benkabou, M.Becker , M.Certier and H.Aourag

Electronic properties of GaPN

Superlattices and Microstructures 23 (1998) 455

106) M.Ferhat, A.Zaoui , M.Certier and H.Aourag

Electronic Structure of BN, BP and BAs

Physica B 252 (1998) 229

107)H.Heireche, B.Bouhafs, H.Aourag, M.Ferhat and M.Certier

Electronic and Optical properties of copper halides mixed crystal CuClBr

J.Phys.Chem.Solids 59 (1998) 997

108)F.Benkabou, B.Bouhafs, M.Certier, A.Zaoui and H.Aourag

Positron annihilation studies in GeSn and SiSn alloys

Phys. Stat.Sol. (b) 206 (1998) 635

109)A.Laref, B.Bouhafs, H.Aourag, and N.Bouarissa

Calculation of the electronic and elastic properties of carbon

J.Phys : Condensed Mater 10 (1998) 3195

110)N.Bouarissa, A.B.Walker and H.Aourag

Backscattering of slow positrons from semi infinite aluminium

J.Appl. Phys. 83 (1998) 3643

111) A.Laref, B.Bouhafs , M.Certier and H.Aourag

Transferable non orthogonal tight binding model for silicon

Phys.Stat. Sol (b) 208 (1998) 413

112) W.Sekkal , B.Bouhafs, M.Certier and H.Aourag

Molecular dynamics simulation of high pressure phases of CuCl and CuBr

J.Phys. Chem. Solids 59 (1998) 1301

113)W. Sekkal , B.Bouhafs, M.Certier and H.Aourag

Molecular dynamics simulation of structural and thermodynamics properties of BN

J.Phys : Condensed Mater 10 (1998) 4975

114) B.Bouhafs, H.Heireche, W.Sekkal, H.Aourag, M.Ferhat and M.Certier

Electronic and optical properties of copper halides mixed crystals CuBrI

Phys.Stat.Sol (b) 209 (1998) 339

115) F.Benkabou, F.Becker, M.Certier and H.Aourag

Structural and Dynamical Properties of GaN

Physica.Status.Solidi. B 209 (1998) 223

116) M.Ferhat, B.Bouhafs, A.Zaoui, M.Certier and H.Aourag

First Principles Study of structural properties of BSb

J.Phys : Condensed matter 10 (1998) 7995

117) Z. Mouffok, H.Aourag, J.D.Moreno and J.M. Martinez-Duart

Quantum size effect from n-type porous silicon

Micorlectronic Engineering 43 (1998) 655

118) M.Rezki, A.Tadjer, H.Abid and H.Aourag

Electronic structure of SiCGe

Mater. Sci. And Eng. B 55 (1998) 157

119) N.Bouarissa, N.Amrane, M.Certier and H.Aourag

Study on momentum density in narrow gap III-V mixed alloys by positron annihilation under pressure

Matter. Sci. Eng. B54 (1998) 161

120) O. Pages, H. Erguig, V. Wagner, A. ZAoui, J.P. Laurenti, J. Guerts, H. Aourag, R.L. Aulombard and M. Certier

Raman and photoreflectance studies of electronic band bending at ZnSe/GaAs interfaces

Thin Solid Films 336 (1998) 381

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1999

121) A.Tadjer, M.Rezki,B.Abbar and H.Aourag

Strain effect in GaN and InN and their alloys

J.Physics and Chemistry of Solids 60 (1999) 419

122) F.Benkabou, Z.Chellahi, H.Aourag, J.P.Becker and M.Certier

Atomistic simulation of BAs from molecular dynamics

Phys.Lett. A 252 (1999) 71

123) W.Sekkal, M.Certier and H.Aourag

Monte carlo calculation of the miscibility of C₆₀C₇₀

Phys. Lett. A 251 (1999) 132

124) W.Sekkal, A.Zaoui, A.Laref, M.Certier and H.Aourag

Structural properties of CBN

J.Phys. Condens. Matter. 11 (1999) 3875

125) A.Zaoui, 0.Pages, W.Sekkal, M.Certier and H.Aourag

Electronic Properties of CBN

Phys. Stat.Sol (b) 212 (1999) 307

126) N.Mecabih, N.Amrane and H.Aourag

Electronic and positronic distribution in ternary alloys HgCdTe

Phys. Stat.Sol. b 212 (1999) 59

127)F.Benkabou, M.Certier, J.P.Becker, H.Aourag

Theoretical studies of Positron anninilation in GaPN

Phys.Stat.Sol (b) 213 (1999) 59

128) M.Certier, M.Soltani, O.Pages, A.Zaoui, W.Sekkal and H.Aourag

Exciton-polariton reflectance in CuI single crystals

Materials. Science. Eng. B58 (1999) 234

129) W.Sekkal, S. Ait Abderrahmane, R.Terki, M.Certier and H.Aourag

Molecular Dynamics simulation of carbon in the clathrate structures

Materials Science and Engineering B64 (1999) 123

130) W.Sekkal, A.Laref, A.Zaoui, M.Certier and H.Aourag

Atomistic simulation of a high pressure phase of AgI using a three-body potential

Solid State Communication 112 (1999) 49

131) B.Bouhafs, M.Ferhat, M.Certier and H.Aourag

Competition between ionic and covalent character in the series of boron compounds BP, Bas and BSb
J.Phys : Condens. Matter 11 (1999) 5781

132)N.Bouarissa and H.Aourag

Effective masses of electron and heavy holes in InAs, InSb, GaSb, GaAs and some of their ternary alloys

Infrared Physics and Technology 40 (1999) 343

133) R. Moussa, H.Aourag, N.Amrane and L. Salomon

Temperature effect on photonic band gap in polymer photonic lattices

Infra. Red Phys. and Tech. 40 (1999) 417

134) Z. Nabi, B. Abbar, N.Amrane and H.Aourag

Electron and positron energy distributions in Cd0.5Mn0.5Te

Mater.Chem. Phys 60 (1999) 256

135) A.Laref, A.Zaoui, W.Sekkal, M.Certier and H.Aourag

Tight binding calculations of electronic of AgI

J.Appl. Phys 86 (1999) 4435

136) L.Lamare , H.Aourag and J.P. Dufour

Cluster-model density functional study of W-Cu(100) STM junction

J.Physics and Chemistry of Solids 60 (1999) 681

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2000

137) A.Laref, B. Bouhafs, A.Zaoui, M.Certier and H.Aourag

Tight-binding calculations of electronic and elastic properties of Ge

Phys. Stat. Sol (b) 217 (2000) 911

138) A. Tadjer, B. Abbar, M. Rezki, J.P. Dufour, H.Aourag and M. Certier

Charge density calculations for strained zinc blende GaN, InN and AlN

Mater. Chem. Phys 62 (2000) 80

139) R. Moussa, A. Zaoui, M. Certier and H. Aourag

Macroporous silicon with photonic band gap at 3 um

Mater. Chem. Phys. 63 (2000) 213

140) R.Moussa, S. Goumri-Said, H.Aourag

Unperturbed and perturbed nonlinear Schrodinger system for optical fiber solitons

Phys.Letters. A , 266 (2000) 173

141) W.Sekkal, A. Laref, A. Zaoui, H.Aourag and M. Certier

The miscibility of copper halides using the three body potential CuClBr crystal

Molecular simulation 23 (2000) 127

142) N. Benosman, N.Amrane and H.Aourag

Calculation of electronic and optical properties of zinc blende ZnCdSe

Physica B 275 (2000) 316

143) S. Mecabih, N.Amrane, B. Belgoumene and H.Aourag

Opto-electronic properties of the ternary alloy HgCdTe

Physica A 276 (2000) 495

144) N. Benosman, N. Amrane, S. Mecabih and H. Aourag

Positron affinity in Zn1-xCdxSe

Journal of Physics and Chemsitry of solids 61, 17271 (2000)

145) Y. Al-Douri, H. Abid and H.Aourag

Some empirical formulas for calculating the ionicity character in semiconductors

Materials Chemistry and Physics, 65, 117 (2000)

146) F. Baameur, A. Krallafa, H. Aourag and B. Khelifa

Molecular dynamics simulation os solid C60 under progressively raised pressure

Phys.Stat.Sol b. 220, 821 (2000)

147) M.B.Kanoun, W. Sekkal, H. Aourag and G. Merad

Molecular dynamics study of the structural, elastic and thermodynamic properties of cadnium telluride

Phys. Lett. A, 272, 113 (2000)

148) F. Benkabou, H. Aourag and M. Certier

Atomistic Study of zinc-blende CdS, CDSe, ZnS and ZnSe from molecular dynamics

Materials Chemistry and Physics, 66, 10 (2000)

149) W. Sekkal, A. Zaoui, A. Laref, M. Certier and H. Aourag

Molecular Dynamics Simulation of CuI using a three-body potential

J.Phys : Condens. Matter 12 , 6173 (2000)

150) N. Benosman, N. Amrane and H. Aourag

Study on anisotropies and momentum densities in CdSe and ZnSe

The Arabian Journal for Science and Engineering, 25, 111 (2000)

151) S. Mecabih, N. Amrane, Z. Nabi, B. Abbar and H. Aourag

Description of structural and electronic properties of TiC and ZrC by generalized gradient approximation.

Physica A, 285, 392 (2000)

152) W. Sekkal, A. Laref, A. Zaoui, M. Certier a nd H. Aourag

The miscibility of CuxAg1-xI using a Tersoff Potential

Superlattices and Microstructures, 28, 55 (2000)

153) W. Sekkal , A. Laref, A. Zaoui, M. Certier and H. Aourag

The miscibility of copper halides using the three-body potential. Part II. CuBrxI1-x crystal.

J. Materials Science 11, 123 (2000)

154) B.Bouhafs, H. Aourag and M. Certier

Trends in band gap pressure coefficients in boron compounds BP, Bas and BsB

J.Phys : Condens. Matter 12 , 5665 (2000)

155) R. Moussa, J.P. Dufour, L. Salomon, M. Certier and H. Aourag

Nitride compouds as photonic crystals in the optical region

J. Materials Science, 11, 623 (2000)

156) A. Zaoui, M. Certier, M. Ferhat, W. Sekkal, O. Pages and H.Aourag

Predicted modifications in the direct and indirect gaps of Ge

Comp. Mat. Sci. 17 (2000) 400

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2001

157) N. Metadjer, A. Laref, B. Khelifa, C. Mathieu, S. Bresson and H. Aourag

Tight-binding calculation os structural properties of bulk Cu3Au and its corresponding clusters.

Superlattices and Microstructures 30, 21 (2001)

158) B. Djellouli and H. Aourag

Structural properties of TiC

Physica status Solidi b, 225, 265 (2001)

159) Y. Al-Douri, H. Abid and H. Aourag

Correlation between the bulk modulus and the charge density in semiconductors

Physica B, 305, 186 (2001)

160) N. Benosman, N. Amrane, S. Mecabih and H. Aourag

Structural and electronic properties of bulk BeS

Physica B, 304, 214 (2001)

161) Y. Al-Douri, H. Abid, A. Zaoui and H. Aourag

Correlation between the ionicity character and the heteropolar band gap in semiconductors

Physica B, 301, 295 (2001)

162) S. Goumri-Said, R. Moussa, J.P. Dufour, L. Salomon and H. Aourag

Numerical study of the one-dimensional Hubbard model in determination of trans-polyacetylene properties.

Physica B, 296, 377 (2001)

163)F. Benkabou, H. Aourag, M. Certier, Teiji Kobayasi

Calculation of the optical and electronic properties of zinc-blende alloy Zn1-xMgxSe

Superlattices and Microstructures 30, 9 (2001)

164) A. Benzair, B. Bouhafs, B. Khelifa , C. Mathieu and H. Aourag

The ground state and the bonding properties of the hypotheticzl cubic zinc-blende-like GeC and SnC compounds

Phys. Lett. A 282, 299 (2001)

165) M. Ferhat, B. Bouhafs,H.Aourag, A. Zaoui and M. Certier

The electronic structure of CuCl

Comp. Mater. Sci. 20, 267 (2001)

166) S. Goumri-Said, H. Aourag, F. De Fornel and L. Salomon

Quantum Monte Carlo Study of the alternating extended Peierls-Hubbard Model applied to the trans-polyacetylene.

Physica B, 301, 299 (2001)

167) H. Feraoun, H. Aourag, T. Grosdidier, D. Klein and C. Coddet

Development of modified embedded atom potentials for the Cu_¯Ag system,

Superlattices and Microstructures 30,261(2001)

168) A. E. Merad, H. Aourag,B. Khelifa and C. Mathieu, G. Merad

Predictions of the bonding properties inCd_1 - xZn_xTe,

Superlattices and Microstructures, 30, 241 (2001)

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2002

169) First principles calculations of optical properties of AlN, GaN and InN compounds under hydrostatic pressure

B. Abbar, B. Bouhafs, H. Aourag, G. Nouet and P. Ruterana

Physica Status Solidi b 228 (2002) 457

170) Large photonic band gap's in one-dimensional multilayer structures

R. Moussa, L. Salomon, J. P. Dufour and H. Aourag

Journal of Physics and chemistry 65 (2002) 725

171) Local excitation of surface plasmon polaritons at discontinuities of a metal film : theoratical analysis and optical near-field measurements

L. Salomon, G. Bassou, H. Aourag, J.P Dufour, and F. de Fornel

Physical Review B 65 (2002) 125409

172) Energetic and Electronic structure of the hypothetical cubic zinc-blende like semiconductors GeC and SnC

A. Benzair and H. Aourag

Physica Status Solidi b 231, 411( 2002)

173) Theoretical analysis of disorder effects on electronic and optical properties of the quaternary alloy Ga_1-xAl_xAs_ySb_1-y,

M. Rabah, H. Abid, B. Bouhafs and H. Aourag

Materials Chemistry and Physics, 74 (2002) 328

174)The behavior of correlation functions in trans-polyacetylene: quantum Monte Carlo study,
S. Goumri-Said, H. Aourag, L. Salomon and J. -P. Dufour

Solid State Sciences, 4 ( 2002) 755

175)Tight-binding calculations: Electronic structure and interfacial properties of (ZnSe)_n / (Si ₂) _msuperlattices,

A. Laref and H. Aourag

Superlattices and Microstructures, 31( 2002)229

176)First principles calculations of the hypothetical interface BN/XC (X = Si, Ge, Sn),
A. Benzair and H. Aourag

Superlattices and Microstructures, 31,( 2002) 219

177)Calculation of bulk moduli of semiconductor compounds,

Y. Al-Douri, H. Abid and H. Aourag

Physica B: Condensed Matter,322,( 2002) 179

178)The effect of pressure on the ionicity of In_¯V compounds,
Y. Al-Douri and H. Aourag

Physica B: Condensed Matter, 324,( 2002) 173

179) Electronic momentum distribution in the one-dimensional extended hubbard model: Determinantal Monte Carlo study,

Goumri-Said S.; Aourag H.; Salomon L.; Dufour J.-P.

Polymer, Volume 43( 2002) 6323

180) A new form of the Sutton_¯Chen potential for the Cu_¯Ag alloys,

H. FeraounC. EslingL. Dembinski, T. Grosdidier, C. Coddet and H. Aourag

Superlattices and Microstructures, 31,( 2002) 297

181) First principles calculations of vacancy-effect on structural and electronic properties of TiCx and TiNx.

Z. Dridi, B. Bouhafs, P. Ruterana and H. Aourag

J. Phys. Condens. Matter. 14 (2002) 10237

182) Ferromagnetic and antiferromagnetic couplings

A. Kellou, N. Fenineche, A. Tadjer and H. Aourag

Journal of Physics and Chemistry of solids 97 (2002) 1

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2003

183)Photonic band gaps in highly ionic medium: CuCl, CuBr, CuI, ,
R. Moussa, L. Salomon, F. de-Fornel, J. P. Dufour and H. Aourag

Infrared Physics & Technology, 44 (2003) 27

184) Elastic properties of zinc-blende GaN, AlN and InN from molecular dynamics

F. Benkabou, M. Certier and H. Aourag

Molecular Simulation 29 (2003) 201

185) Pressure effect on electronic and positron charge densities of ZnCdSe

Y. Aldouri, S. Mecabih, N. Benosman and H. Aourag

Physica B, 325 (2003) 362

186)A modified embedded atom method study of the high pressure phases of silicon, ,
N. Badis, H. Feraoun, H. Aourag and M. Certier

Materials Chemistry and Physics, 80 (2003) 405

187)Full potential calculation of structural, electronic and optical properties of CdSiP₂ and CdGeP₂, ,
F. Chiker, B. Abbar, A. Tadjer, H. Aourag and B. Khelifa

Materials Science and Engineering B, 98 (2003) 81

188)FP-LAPW investigations of electronic structure and bonding mechanism of NbC and NbN compounds,

T. Amriou, B. Bouhafs, H. Aourag, B. Khelifa, S. Bresson and C. Mathieu

Physica B: 325 (2003) 45

189) Quantum Monte Carlo study of insulating state in NaV₂O₅,

S. Goumri-Said and H. Aourag

Journal of Alloys and Compounds, Volume 354, (2003) 24

190) Quantum Monte-Carlo calculation of correlation functions of undistorted, cis-distorted and trans-distorted polyacene,

S. Goumri-Said, H. Aourag, L. Salomon and J. -P. Dufour

Polymer, Volume 44 (2003)1765

191) Photonic band gaps in highly ionic medium: CuCl, CuBr, CuI,

R. Moussa, L. Salomon, F. de-Fornel, J. P. Dufour and H. Aourag

Infrared Physics & Technology, 44 ( 2003) 27

192) Diffusion, surface alloy formation, and spin alignment in Fe/Cr(001) systems and superlattices

A.Kellou and H. Aourag

Physica status solidi b 236 (2003) 166

193) Structural relationship between V₂O₅ (0 0 1) surface and the bulk: cluster bulk termination models,

A. D. Sayede, C. Mathieu, B. Khelifa and H. Aourag

Materials Chemistry and Physics, 81( 2003) 183

194)Theoretical Studies of Substoichiometric CuI

H. Feraoun, M. Certier and H. Aourag

Materials Chemistry and Physics, 82 ( 2003) 597

196) structural stability and magnetic properties in X2AlX’ heusler alloys from quantum mechanical calculations

H. Kellou, N. Fennineche, T. Grosdidier, C. Coddet and H. Aourag

J. Applied.Physics 94 (2003) 3292

197) Quantum mechanical study of clean and H-covered a-MoO3(100) surface

A. Sayede, B. Khelifa , C. Mathieu and H. Aourag

J. Theo.and Quant. Chem 2 (2003) 1

198) Ab initio study of electronic properties of zincblende AlN and deformation potentials under hydrostatic stress,

A. E. Merad, M. B. Kanoun, J. Cibert, H. Aourag and G. Merad

Materials Chemistry and Physics, 82 (2003) 471

199)Numerical study on localized defect modes in two-dimensional lattices: a high Q-resonant cavity,

R. Moussa, L. Salomon, F. de Fornel and H. Aourag

Physica B: Condensed Matte 338 (2003) 97

200) Stress-dependence tight binding study of tellurium-based II–VI semiconductors,

A. E. Merad, M. B. Kanoun, J. Cibert, H. Aourag and G. Merad

Physics Letters A,315 (2003) 143

201) Theory of positron superlattices and the investigation of the possibility of probing heterostructures with positrons,

Nadir Sekkal and Hafid Aourag

Superlattices and Microstructures, 33 (2003) 63

202) Composition dependence of the positron annihilation in Zn_1-xMg_xSe,

F. Benkabou, H. Aourag, M. Certier and Teiji Kobayasi

Physica B: Condensed Matter, 336 (2003) 275

203) Ab initio study of sodium intercalation into metal oxides,

T. Amriou, B. Khelifa, C. Mathieu and H. Aourag

Solid State Ionics, 160 ( 2003) 351

204) Molecular-dynamics simulations of structural and thermodynamic properties of ZnTe using a three-body potential,

M. B. Kanoun, A. E. Merad, H. Aourag, J. Cibert and G. Merad

Solid State Sciences, 5 (2003) 1211

205) Effect of spin orbit on the electronic properties of zinc-blende compounds

Y. Al-Douri, R. Khenata, Z. Chelahi-chikr, M. Driz and H. Aourag

J. Appl. Phys. 94 (2003) 4502

206) Electronic study of FeTi , CoTi and NiTi alloys: Bulk, surfaces and interfaces

Kellou, Z. Nabi, A.Tadjer , N. Amrane, N. Fennineche and H. Aourag

Physica. Status Solidi b 239 (2003) 389

207) Role of interface states in electronic properties of (ZnSe)_n/(Si₂)_n (001) superlattices

A. Laref, H. Aourag, B. Belgoumene, and A. Tadjer

J. Appl. Phys. 94 (2003) 5027

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2004

208) Ab initio calculations and experimental studies of site substitution of ternary elements in WC

T. Saharaoui, A. Kellou, H.I. Feraoun, N. Fennineche and H. Aourag

Materials Enginnering B 107 (2004) 1

209) Properties of strained zinc-blende GaN: first-principles study,

M. B. Kanoun, A. E. Merad, J. Cibert, H. Aourag and G. Merad

Journal of Alloys and Compounds, 366 (2004) 86

210) Lithium intercalation effects on the V₂O₅ (001) surface,

A. D. Sayede, B. Khelifa, M. Pernisek, C. Mathieu and H. Aourag

Solid State Ionics, 166 (2004) 175

211) Ab initio total energy calculations of the optical properties of the CdSnP₂ ternary pnictide semiconductor,

F. Chiker, B. Abbar, H. Aourag, A. Tadjer, S. Bresson, B. Khelifa and C. Mathieu

Chemical Physics,298 (2004) 135

212)Structure and magnetic properties study of iron-based thermally sprayed alloys, Materials

N. E. Fenineche, M. Cherigui, H. Aourag and C. Coddet

Letters58 (2004) 1797

213)FeNb and FeSi thermal spraying coatings: microstructure and first principle calculations,

N. E. Fenineche , M. Cherigui , H. I. Feraoun , H. Aourag and C. Coddet

Materials Science and Engineering B, 107 (2004) 27

214)New quantum Monte Carlo formulation for modeling trans-polyacetylene properties: specific heat calculation,

Souraya Goumri-Said and Hafid Aourag

Polymer, 45 (2004) 2443

215)First principles study of structural, electronic, elastic and optical properties of MgS, MgSe and MgTe,

F. Drief , A. Tadjer , D. Mesri and H. Aourag

Catalysis Today, 89 (2004) 343

216)Structure of amorphous iron-based coatings processed by HVOF and APS thermally spraying,

M. Cherigui , H. I. Feraoun , N. E. Feninehe , H. Aourag and C. Coddet

Materials Chemistry and Physics, 85 (2004) 113-119

217)Numerical study of photolithography system: electromagnetic differential method,

S. Goumri-Said , L. Salomon , J. -P. Dufour and H. Aourag

Journal of Materials Processing Technology, 148 ( 2004) 50,

218)Effect of Al-doping on lithium nickel oxides,

T. Amriou , A. Sayede , B. Khelifa , C. Mathieu and H. Aourag

Journal of Power Sources, 130 ( 2004) 213,

219)Prediction study of elastic properties under pressure effect for zincblende BN, AlN, GaN and InN,

M. B. Kanoun, A. E. Merad, G. Merad, J. Cibert and H. Aourag

Solid-State Electronics, 48 (2004) 1601

220)Prediction of structural and thermodynamic properties of zinc-blende AlN: molecular dynamics simulation,

Souraya Goumri-Said, Mohammed Benali Kanoun, Abdelkarim E. Merad, Ghouti Merad and Hafid Aourag

Chemical Physics, 302 (2004) 135

T. Sahraoui, H. I. Feraoun, N. Fenineche, G. Montavon, H. Aourag and C. Coddet

Materials Letters, 58 (2004) 2433,

222)Energetics and electronic properties of vacancies, anti-sites, and atomic defects (B, C, and N) in B2-FeAl alloys,

A. Kellou, H. I. Feraoun, T. Grosdidier, C. Coddet and H. Aourag

Acta Materialia, 52 (2004) 3263

223)Analytical investigation of solitary waves in nonlinear Kerr medium
Goumri-Said, S. / Moussa, R. / Belgoumene, B. / Aourag, H.,

Optical Materials Volume 27, Issue 2 , November 2004, Pages 203-209

224)Empirical formula relating the bulk modulus to the lattice constant in tetrahedral semiconductors
Al-Douri, Y. / Abid, H. / Aourag, H.,

Materials Chemistry and Physics, Sep 2004

225) Empirical molecular dynamics study of structural, elastic and thermodynamic properties of zinc-blende-like SiGe compound
Souraya Goumri-Said, Mohammed Benali Kanoun, Abdelkarim E. Merad, Ghouti Merad and Hafid Aourag
Materials Science and Engineering B, Volume 111, Issues 2-3, 25 August 2004, Pages 207-213

226)Electronic structure of Ti₂CAl and Ti₂NAl

H. Faraoun, R. Terki, C. Esling and H. Aourag

Materials Science and Engineering B, Volume 110, Issue 3, 25 July 2004, Pages 280-284

227) Structural, electronic and optical calculations of Cu(In,Ga)Se2 ternary chalcopyrites
M. Belhadj, A. Tadjer, B. Abbar, Z. Bousahla, B. Bouhafs, H. Aourag

physica status solidi (b) Volume 241, Issue 11, Date: September 2004, Pages: 2516-2528

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2005

228)Electronic structure and interfacial properties of ZnSe/Si, ZnSe/Ge, and ZnSe/SiGe superlattices

A. Laref, B. Belgoumene, H. Aourag, M. Maachou and A. Tadjer

Superlattices and Microstructures, Volume 37, Issue 2, February 2005, Pages 127-137

229) Theoretical study of structural, electronic, and thermal properties of Cr₂(Zr,Nb) Laves alloys •
A. Kellou, T. Grosdidier, C. Coddet and H. Aourag

Acta Materialia, Volume 53, Issue 5, March 2005, Pages 1459-1466

230)First principles calculations of structural, elastic and electronic properties of XO₂ (X = Zr, Hf and Th) in fluorite phase
R. Terki, H. Feraoun, G. Bertrand and H. Aourag

Computational Materials Science, Volume 33, Issues 1-3, April 2005, Pages 44-52

231)Elastic properties of binary NiAl, NiCr and AlCr and ternary Ni₂AlCr alloys from molecular dynamic and Abinitio simulation
H. Faraoun, H. Aourag, C. Esling, J.L. Seichepine and C. Coddet

Computational Materials Science, Volume 33, Issues 1-3, April 2005, Pages 184-191

232)Ab initio investigation of the Jahn–Teller distortion effect on the stabilizing lithium intercalated compounds
T. Amriou, B. Khelifa, H. Aourag, S.M. Aouadi and C. Mathieu

Materials Chemistry and Physics Volume 92, Issues 2-3, 15 August 2005, Pages 499-504

233) Full-potential investigation of the electronic and optical properties of stressed CdTe and ZnTe

A.E. Merad, M.B. Kanoun, G. Merad, J. Cibert and H. Aourag

Materials Chemistry and Physics

234) Correlation between the bulk modulus and the transition pressure in semiconductors
Y. Al-Douri, H. Abid and H. Aourag

Materials Letters Volume 59, Issue 16, 1 July 2005, Pages 2032-203

235) Full potential linearized augmented plane wave investigations of structural and electronic properties of pyrochlore systems
R. Terki / H. Feraoun / G. Bertrand / H. Aourag,

Journal of Applied Physics, 96, 6482 (2004

236) Zinc-blende AlN and GaN under pressure: structural, electronic, elastic and piezoelectric properties
M B Kanoun et al
Semicond. Sci. Technol. 19 1220-1231, 2004

237) Full potential calculation of structural, elastic and electronic properties of BaZrO3 and SrZrO3

R. Terki, H. Aourag and G. Bertrand
physica status solidi (b) Volume 242, Issue 5, Date: April 2005, Pages: 1054-1062

238) Ab initio study of the stability of X (X=Cr, Nb, Ag) ultra-thin layers on Cu(001)
A. Kellou, T. Grosdidier, A. Tadjer, C. Coddet and H. Aourag

Thin Solid Films, Volume 489, Issues 1-2, 1 October 2005, Pages 344-349

239) Effect of oxygen deficiencies and the substitution of fluorine on the electronic states in YBa₂Cu₃O_7 − δ superconductors
K. Larbaoui, A. Tadjer, B. Abbar, H. Aourag, B. Khelifa and C. Mathieu

Journal of Alloys and Compounds, In Press, Corrected Proof, Available online 22 August 2005,

240) Full-potential investigation of the electronic and optical properties of stressed CdTe and ZnTe
A.E. Merad, M.B. Kanoun, G. Merad, J. Cibert and H. Aourag

Materials Chemistry and Physics, Volume 92, Issues 2-3, 15 August 2005, Pages 333-339

241) Full potential investigations of structural and electronic properties of ZrSiO₄ • ARTICLE
R. Terki, G. Bertrand and H. Aourag

Microelectronic Engineering, Volume 81, Issues 2-4, August 2005, Pages 514-523

242) State of the art simulations in electronic structure and total energy for the high temperature superconductor YBa₂Cu₃O₇

K. Larbaoui, A. Tadjer, B. Abbar, H. Aourag, B. Khelifa and C. Mathieu
Journal of Alloys and Compounds, 403 (2005) 1 2005,

243) First-principles calculations of the structural, electronic and optical properties of IIA-IV antifluorite compounds
O. Benhelal, A. Chahed, S. Laksari, B. Abbar, B. Bouhafs, H. Aourag

physica status solidi (b)Volume 242, Issue 10, Date: August 2005, Pages: 2022-2032

2006

244) Paramagnetic susceptibility of ferrite and cementite obtained from ab initio calculations • ARTICLE
Journal of Magnetism and Magnetic Materials, Volume 299, Issue 1, April 2006, Pages 64-69
Y.D. Zhang, H. Faraoun, C. Esling, L. Zuo and H. Aourag

245) Study of stability of twist grain boundaries in hcp zinc • ARTICLE
Scripta Materialia, Volume 54, Issue 5, March 2006, Pages 865-868
H. Faraoun, G. Vincent, C. Esling and H. Aourag

246) Comparative behavior of vacancy and C, B, N, O atoms single defect on hardening the B2-FeAl structure: An atomistic study • ARTICLE
Intermetallics, Volume 14, Issue 2, February 2006, Pages 142-148
A. Kellou, T. Grosdidier and H. Aourag

247) Electronic structure of some mono-, semi-titanium boride and diboride • SHORT COMMUNICATION
Materials Letters, Volume 60, Issue 12, June 2006, Pages 1433-1436
B. Mouffok, H. Feraoun and H. Aourag

248) Vacancy effect in CuAg alloys • SHORT COMMUNICATION
Materials Letters, Volume 60, Issue 11, May 2006, Pages 1344-1346
B. Mouffok, H. Feraoun and H. Aourag

249) Crystalline, Electronic and Magnetic Structures of q-Fe3C, c-Fe5C2 and h-Fe2C from First Principle Calculation

Journal of Applied Physics In press

H. FEraoun, C. Esling and H. Aourag

250) Two Body Buckimgham Potential for CuCl, CuBr and CuI

physica status solidi (b), Volume 243, Issue 6, Date: May 2006, Pages: 1182-1192
B. Mouffok, H. Feraoun, H. Aourag

251) Electronic structure and optical properties of (ZnSe)_n/(Si₂)_m (111) superlattices

J. Applied Physics 99 (2006) 043702

A. Laref, S. Laref, B. Belgoumene, B. Bouhafs, A. Tadjer, and H. Aourag

252) Modelling route for abradable coatings

Surface and Coatings Technology, Volume 200, Issues 22-23, 20 June 2006, Pages 6578-6582
H.I. Faraoun, J.L. Seichepine, C. Coddet, H. Aourag, J. Zwick, N. Hopkins, D. Sporer and M. Hertter

253) Effect of oxygen deficiencies and the substitution of fluorine on the electronic states in YBa₂Cu₃O_7 − δ superconductors
Journal of Alloys and Compounds, Volume 414, Issues 1-2, 13 April 2006, Pages 20-25
K. Larbaoui, A. Tadjer, B. Abbar, H. Aourag, B. Khelifa and C. Mathieu

254) Structural and electronic properties of zirconia phases: A FP-LAPW investigations
Materials Science in Semiconductor Processing, Volume 9, Issue 6, December 2006, Pages 1006-1013
R. Terki, G. Bertrand, H. Aourag and C. Coddet

255) Improvement of thermally sprayed abradable coating by microstructure control
Surface and Coatings Technology, Volume 201, Issue 6, 4 December 2006, Pages 2303-2312
H.I. Faraoun, T. Grosdidier, J.-L. Seichepine, D. Goran, H. Aourag, C. Coddet, J. Zwick and N. Hopkins

2007

256) Atomistic study of structural, elastic, electronic and thermal properties of perovskites Ba(Ti,Zr,Nb)O₃
Computational Materials Science, Volume 39, Issue 4, June 2007, Pages 896-902
N. Iles, A. Kellou, K. Driss Khodja, B. Amrani, F. Lemoigno, D. Bourbie and H. Aourag

257) Ab initio calculations of structural and electronic properties of Y₂Ti₂O₇ and Cd₂Nb₂O₇
Physica B: Condensed Matter, Volume 392, Issues 1-2, 15 April 2007, Pages 341-347
R. Terki, G. Bertrand, H. Aourag and C. Coddet

2008

258)Thermal properties of Ba_1−xSr_xZrO₃ compounds from microscopic theory
Journal of Alloys and Compounds, In Press, Corrected Proof, Available online 1 March 2007
R. Terki, G. Bertrand, H. Aourag and C. Coddet

259) Cubic-to-tetragonal phase transition of HfO₂ from computational study
Materials Letters, Volume 62, Issues 10-11, 15 April 2008, Pages 1484-1486
R. Terki, G. Bertrand, H. Aourag and C. Coddet

260) Simulation of thermal properties of Ba₁₋_xZrO₃ compounds for thermal barrier coating applications
Computational Materials Science, In Press, Corrected Proof, Available online 17 March 2008
R. Terki, G. Bertrand, H. Aourag and C. Coddet

261) Atomistic study of magnetism on structural stability of Fe3Al and Fe3AlX alloys
Physica Status Solidi b, In Press, Corrected Proof, Available online 17 March 2008
A. Kellou, T. Grosdidier, M. Raulot and, H. Aourag

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