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Number of items: 37.

Article

Kodan, Nisha and Auluck, S. and Mehta, B. R. (2016) A DFT study of the electronic and optical properties of a photovoltaic absorber material Cu2ZnGeS4 using GGA and mBJ exchange correlation potentials. Journal of Alloys and Compounds, 675. 236-243. ISSN 0925-8388

Kumar, S. and Joshi, Suman and Gupta, S. K. and Auluck, S. (2016) Band gap engineering of CuAl1-xInxS2 alloys for photovoltaic applications: a first principles study. JOURNAL OF PHYSICS D-APPLIED PHYSICS , 49 (20). pp. 205103-1. ISSN 0022-3727

Tyagi, Kriti and Gahtori, Bhasker and Bathula, Sivaiah and Singh, Niraj Kumar and Bishnoi, Swati and Auluck, S. and Srivastava, A. K. and Dhar, Ajay (2016) Electrical transport and mechanical properties of thermoelectric tin selenide. RSC Advances, 6 (14). pp. 11562-11569. ISSN 2046-2069

Kumar, S. and Joshi, Suman and Joshi, B. and Auluck, S. (2015) Thermodynamical and electronic properties of BxAl1-xN alloys: A first principle study. Journal of Physics and Chemistry of Solids, 86. pp. 101-107. ISSN 0022-3697

Reshak, A. H. and Kamarudin, H. and Auluck, S. (2015) Electronic structure of alkali-metal/alkaline-earth-metal fluorine beryllium borate NaSr3Be3B3O9F4 single crystal: DFT approach. Optical Materials , 48. pp. 25-30. ISSN 0925-3467

Reshak, A. H. and Kityk, I. V. and Alahmed, Z. A. and Levkovets, S. and Fedorchuk, A. O. and Myronchuk, G. and Plucinski, K. J. and Kamarudin, H. and Auluck, S. (2015) Experimental and theoretical investigation of the electronic structure and optical properties of TlHgCl3 single crystal. Optical Materials, 47. pp. 445-452. ISSN 0925-3467

Reshak, A. H. and Chen, X. and Kamarudin, H. and Chen, Y. and Auluck, S. (2015) Non-centrosymmetric LiBaB9O15 single crystal: growth and characterization. Indian Journal of Physics, 89 (9). 923-929. ISSN 0019-5480

Kumar, S. and Joshi, Suman and Auluck, S. (2015) An ab-initio study of CuInSe2 based ordered defect compounds. Materials Chemistry and Physics , 162. pp. 372-379. ISSN 0254-0584

Pulikkotil, J. J. and Auluck, S. (2015) Anisotropy and high thermopower of LaOBiS2. Journal of Alloys and Compounds, 626. pp. 208-211. ISSN 0925-8388

Pulikkotil, J. J. and Auluck, S. (2015) Band gap engineering of Si-Ge alloys for mid-temperature thermoelectric applications. AIP Advances, 5 (3). ISSN 2158-3226

Reshak, A. H. and Huang, Hongwei and Kamarudin, H. and Auluck, S. (2015) Alkali-metal/alkaline-earth-metal fluorine beryllium borate NaSr3Be3B3O9F4 with large nonlinear optical properties in the deep-ultraviolet region. Journal of Applied Physics, 117 (8). ISSN 0021-8979

Reshak, A. H. and Auluck, S. (2015) Thermoelectric properties of Nowotny-Juza NaZnX (X = P, As and Sb) compounds. Computational Materials Science, 96. pp. 90-95. ISSN 0927-0256

Ma, Lan and Xia, Zhiguo and Atuchin, Victor and Molokeev, Maxim and Auluck, S. and Reshak, A. H. and Liu, Quanlin (2015) Engineering oxygen vacancies towards self-activated BaLuAlxZn4-xO7-(1-x)/2 photoluminescent materials: an experimental and theoretical analysis. Physical Chemistry Chemical Physics, 17 (46). 31188-31194 . ISSN 1463-9076

Reshak, A. H. and Auluck, S. (2014) Dispersion of the linear and nonlinear optical susceptibilities of Bismuth subcarbonate Bi2O2CO3: DFT calculations. Optical Materials, 38. pp. 80-86. ISSN 0925-3467

Tyagi, Kriti and Gahtori, Bhasker and Bathula, Sivaiah and Auluck, S. and Dhar, Ajay (2014) Band structure and transport studies of copper selenide: An efficient thermoelectric material. Applied Physics Letters, 105 (17). ISSN 0003-6951

Reshak, A.H. and Alahmed, Z. A. and Auluck, S. (2014) density functional study of the electronic properties of bismuth subcarbonate Bi2O2CO3. Solid State Sciences, 38. pp. 138-142. ISSN 1293-2558

Reshak, A. H. and Auluck, S. (2014) Adsorbing H2S onto a single graphene sheet: A possible gas sensor. Journal of Applied Physics, 116 (10). 103702-1-103702-10. ISSN 0021-8979

Reshak, A. H. and Brik, M. G. and Auluck, S. (2014) Dispersion of the linear and nonlinear optical susceptibilities of the CuAl(S1-xSex)(2) mixed chaclcopyrite compounds. Journal of Applied Physics, 116 (10). ISSN 0021-8979

Anand, Kanika and Pulikkotil, J. J. and Auluck, S. (2014) Effects of inter-site chemical disorder on the magnetic properties of MnBi. Journal of Magnetism and Magnetic Materials , 363. pp. 18-20. ISSN 0304-8853

Anand, Kanika and Pulikkotil, J. J. and Auluck, S. (2014) Study of ferromagnetic instability in tau-MnAl, using first-principles. Journal of Alloys and Compounds, 601. 234-237. ISSN 0925-8388

Reshak, A. H. and Kamarudin, H. and Alahmed, Z. A. and Auluck, S. and Chyský, Jan (2014) Density functional study of electronic, charge density, and chemical bonding properties of 9-methyl-3-Thiophen-2-YI-Thieno [3,2-e] [1,2,4] Thriazolo [4,3-c] pyrimidine-8-Carboxylic acid ethyl ester crystals. Journal of Magnetism and Magnetic Materials, 361. pp. 206-211. ISSN 0304-8853

Reshak, A. H. and Nouneh, K. and Kityk, I. V. and Bila, Jiri and Auluck, S. and Kamarudin, H. and Sekkat, Z. (2014) Structural, Electronic and Optical Properties in Earth-Abundant Photovoltaic Absorber of Cu2ZnSnS4 and Cu2ZnSnSe4 from DFT calculations. INTERNATIONAL JOURNAL OF ELECTROCHEMICAL SCIENCE, 9 (2). pp. 955-974. ISSN 1452-3981

Reshak, A. H. and Auluck, S. (2014) Electronic and optical properties of chair-like and boat-like graphane. RSC Advances, 4 (70). pp. 37411-37418. ISSN 2046-2069

Reshak, A. H. and Ayaz Khan, Saleem and Auluck, S. (2014) Electronic band structure and specific features of AA- and AB-stacking of carbon nitride (C3N4): DFT calculation. RSC Advances, 4 (14). pp. 6957-6964. ISSN 2046-2069

Reshak, A. H. and Khan, Saleem Ayaz and Auluck, S. (2014) Linear and nonlinear optical properties for AA and AB stacking of carbon nitride polymorph (C3N4). RSC Advances, 4 (23). 11967-11974 . ISSN 2046-2069

Reshak, A. H. and Khan, Saleem Ayaz and Auluck, S. (2014) Thermoelectric properties of a single graphene sheet and its derivatives. Journal of Materials Chemistry C, 2 (13). pp. 2346-2352. ISSN 2050-7526

Pulikkotil, J. J. and Auluck, S. and Kumar, Pramod and Dogra, Anjana and Budhani, R. C. (2011) Energetics and electronic structure of La/Sr disorder at the interface of SrTiO3/LaTiO3 heterostructure. Applied Physics Letters, 99 (8). 081915 . ISSN 1077-3118

Reshak, Ali Hussain and Kamarudin, H. and Auluck, S. (2011) Bismuth-containing semiconductors: Linear and nonlinear optical susceptibilities of GaAs1−x Bix alloys. Journal of Alloys and Compounds, 509 (40). 9685-9691. ISSN 0925-8388

Reshak, Ali Hussain and Stys , Dalibor and Auluck , S. and Kityk , I. V. (2011) Structural properties and bonding nature of 3-methyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole single crystal. Materials Chemistry and Physics, 130 (1-2). pp. 458-465. ISSN 0254-0584

Reshak, Ali Hussain and Kamarudin, H. and Kityk, I. V. and Khenata, R. and Auluck, S. (2011) Electronic band structure and optical properties of titanium oxyphosphates Li0.50Co0.25TiO(PO4) single crystals: An ab-initio calculations. Journal of Solid State Chemistry, 184 (8). pp. 2131-2138. ISSN 0022-4596

Reshak, Ali Hussain and Auluck, S. and Stys, Dalibor and Kityk, I. V. and Kamarudin, H. and Berdowski, J. and Tylczynski, Z. (2011) Dispersion of linear and non-linear optical susceptibilities for amino acid 2-aminopropanoic CH3CH(NH2)COOH single crystals: experimental and theoretical investigations. Journal of Materials Chemistry , 21 (43). pp. 17219-17228. ISSN 0959-9428

Reshak, Ali H. and Kamarudin, H. and Auluck, S. and Minofar, B. and Kityk, I. V. (2011) Electronic structure, chemical bonding features, and electron charge density of the double-cubane single crystal [Sb7S8Br2](AlCl4)3. Applied Physics Letters, 98 (20). 201903. ISSN 1077-3118

Reshak, Ali H. and Shalaginov, Mikhail Y. and Saeed, Yasir and Kityk, I. V. and Auluck, S. (2011) First-Principles Calculations of Structural, Elastic, Electronic, and Optical Properties of Perovskite-type KMgH3 Crystals: Novel Hydrogen Storage Material. Journal of Physical Chemistry B , 115 (12). 2836 -2841. ISSN 1520-5207

Reshak, Ali Hussain and Auluck, S. and Kityk, I. V. (2011) Density Functional Calculations, Electronic Structure, and Optical Properties of Molybdenum Bimetallic Nitrides Pt2Mo3N and Pd2Mo3N. Journal of Physical Chemistry B , 115 (13). 3363-3370. ISSN 1520-5207

Reshak, Ali Hussain and Kityk, I. V. and Khenata, R. and Auluck, S. (2011) Effect of increasing tellurium content on the electronic and optical properties of cadmium selenide telluride alloys CdSe1−x Tex : An ab initio study. Journal of Alloys and Compounds, 509 (24). 6737-6750. ISSN 0925-8388

Reshak, Ali Hussain and Kityk, I. V. and Auluck, S. (2010) Investigation of the Linear and Nonlinear Optical Susceptibilities of KTiOPO4 Single Crystals: Theory and Experiment. Journal of Physical Chemistry B , 114 (50). pp. 16705-16712. ISSN 1520-5207

Reshak, Ali. H. and Stys, D. and Auluck, S. and Kityk, I. V. (2010) Dispersion of linear and nonlinear optical susceptibilities and the hyperpolarizability of 3-methyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole. Physical Chemistry Chemical Physics , 13 (7). pp. 2945-2952. ISSN 1463-9084

This list was generated on Thu Dec 14 02:20:20 2017 IST.