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Structural and electronic properties of SrxBa1-xSnO3 from first principles calculations, , , , , and . JOURNAL OF SOLID STATE CHEMISTRY, (2012)Anhydrous crystals of DNA bases are wide gap semiconductors, , , , , and . JOURNAL OF CHEMICAL PHYSICS, (2011)Structural, optoelectronic, infrared and Raman spectra of orthorhombic SrSnO3 from DFT calculations, , , , , and . JOURNAL OF SOLID STATE CHEMISTRY, 184 (4): 921-928 (2011)Switching on magnetism in Ni-doped graphene: Density functional calculations, , , , , , and . PHYSICAL REVIEW B, (2008)Structural and optoelectronic properties, and infrared spectrum of cubic BaSnO3 from first principles calculations, , , , , , and . JOURNAL OF APPLIED PHYSICS, (2012)Monoclinic and orthorhombic cysteine crystals are small gap insulators, , , , , , , and . CHEMICAL PHYSICS LETTERS, 512 (4-6): 208-210 (2011)Graphene Nanoflakes: Thermal Stability, Infrared Signatures, and Potential Applications in the Field of Spintronics and Optical Nanodevices, , , , , and . JOURNAL OF PHYSICAL CHEMISTRY C, 114 (41): 17472-17485 (2010)beta-Carotene encapsulation into single-walled carbon nanotubes: a theoretical study, , , and . MOLECULAR SIMULATION, 36 (13): 1031-1034 (2010)