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Dispersion of linear and nonlinear optical susceptibilities and the hyperpolarizability of 3-methyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole
Dispersion of linear and nonlinear optical susceptibilities and the hyperpolarizability of 3-methyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole
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Dispersion of linear and nonlinear optical susceptibilities and the hyperpolarizability of 3-methyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole

Reshak, Ali. H ; Stys, D ; Auluck, S ; Kityk, I. V

Physical chemistry chemical physics : PCCP, 2011-01, Vol.13 (7), p.2945-2952 [Periódico revisado por pares]

Cambridge: Royal Society of Chemistry

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2
DFT calculation for elastic constants of orthorhombic structure within WIEN2K code: A new package (ortho-elastic)
DFT calculation for elastic constants of orthorhombic structure within WIEN2K code: A new package (ortho-elastic)
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DFT calculation for elastic constants of orthorhombic structure within WIEN2K code: A new package (ortho-elastic)

Reshak, Ali H. ; Jamal, Morteza

Journal of alloys and compounds, 2012-12, Vol.543, p.147-151 [Periódico revisado por pares]

Kidlington: Elsevier B.V

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3
Electronic structure, magnetism and robust half-metallicity of new quaternary Heusler alloy FeCrMnSb
Electronic structure, magnetism and robust half-metallicity of new quaternary Heusler alloy FeCrMnSb
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Electronic structure, magnetism and robust half-metallicity of new quaternary Heusler alloy FeCrMnSb

Singh, Mukhtiyar ; Saini, Hardev S. ; Thakur, Jyoti ; Reshak, Ali H. ; Kashyap, Manish K.

Journal of alloys and compounds, 2013-12, Vol.580, p.201-204 [Periódico revisado por pares]

Kidlington: Elsevier B.V

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4
Calculation of the lattice constant of hexagonal compounds with two dimensional search of equation of state and with semilocal functionals a new package (2D-optimize)
Calculation of the lattice constant of hexagonal compounds with two dimensional search of equation of state and with semilocal functionals a new package (2D-optimize)
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Calculation of the lattice constant of hexagonal compounds with two dimensional search of equation of state and with semilocal functionals a new package (2D-optimize)

Reshak, Ali H. ; Jamal, Morteza

Journal of alloys and compounds, 2013-04, Vol.555, p.362-366 [Periódico revisado por pares]

Kidlington: Elsevier B.V

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5
GGA+U studies of the cubic perovskites BaMO3 (M=Pr, Th and U)
GGA+U studies of the cubic perovskites BaMO3 (M=Pr, Th and U)
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GGA+U studies of the cubic perovskites BaMO3 (M=Pr, Th and U)

Ali, Zahid ; Ahmad, Iftikhar ; Reshak, Ali H.

Physica. B, Condensed matter, 2013-02, Vol.410, p.217-221 [Periódico revisado por pares]

Kidlington: Elsevier B.V

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6
Emergence of half metallicity in Cr-doped GaP dilute magnetic semiconductor compound within solubility limit
Emergence of half metallicity in Cr-doped GaP dilute magnetic semiconductor compound within solubility limit
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Emergence of half metallicity in Cr-doped GaP dilute magnetic semiconductor compound within solubility limit

Saini, Hardev S. ; Singh, Mukhtiyar ; Reshak, Ali H. ; Kashyap, Manish K.

Journal of alloys and compounds, 2012-09, Vol.536, p.214-218 [Periódico revisado por pares]

Kidlington: Elsevier B.V

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7
Disorder dependent half-metallicity in Mn2CoSi inverse Heusler alloy
Disorder dependent half-metallicity in Mn2CoSi inverse Heusler alloy
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Disorder dependent half-metallicity in Mn2CoSi inverse Heusler alloy

Singh, Mukhtiyar ; Saini, Hardev S. ; Thakur, Jyoti ; Reshak, Ali H. ; Kashyap, Manish K.

Journal of solid state chemistry, 2013-12, Vol.208, p.71-77 [Periódico revisado por pares]

Amsterdam: Elsevier Inc

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8
Accounting oxygen vacancy for half-metallicity and magnetism in Fe-doped CeO2 dilute magnetic oxide
Accounting oxygen vacancy for half-metallicity and magnetism in Fe-doped CeO2 dilute magnetic oxide
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Accounting oxygen vacancy for half-metallicity and magnetism in Fe-doped CeO2 dilute magnetic oxide

Saini, Hardev S. ; Singh, Mukhtiyar ; Reshak, Ali H. ; Kashyap, Manish K.

Computational materials science, 2013-06, Vol.74, p.114-118 [Periódico revisado por pares]

Amsterdam: Elsevier B.V

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9
Dispersion of Linear, Nonlinear Optical Susceptibilities and Hyperpolarizability of C11H8N2O (o‑Methoxydicyanovinylbenzene) Crystals
Dispersion of Linear, Nonlinear Optical Susceptibilities and Hyperpolarizability of C11H8N2O (o‑Methoxydicyanovinylbenzene) Crystals
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Dispersion of Linear, Nonlinear Optical Susceptibilities and Hyperpolarizability of C11H8N2O (o‑Methoxydicyanovinylbenzene) Crystals

Reshak, Ali H ; Kamarudin, H ; Kityk, I. V ; Auluck, S

The journal of physical chemistry. B, 2012-11, Vol.116 (45), p.13338-13343 [Periódico revisado por pares]

United States: American Chemical Society

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10
Full-potential calculation of the structural, elastic, electronic and magnetic properties of XFeO3 (X = Sr and Ba) perovskite
Full-potential calculation of the structural, elastic, electronic and magnetic properties of XFeO3 (X = Sr and Ba) perovskite
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Full-potential calculation of the structural, elastic, electronic and magnetic properties of XFeO3 (X = Sr and Ba) perovskite

RACHED, H ; RACHED, D ; RABAH, M ; KHENATA, R ; RESHAK, Ali H

Physica. B, Condensed matter, 2010-09, Vol.405 (17), p.3515-3519 [Periódico revisado por pares]

Kidlington: Elsevier

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