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The Journal of Chemical Physics|May 2, 2008
Möbius and twisted graphene nanoribbons: stability, geometry, and electronic propertiesE W S Caetano, V N Freire, S G Dos Santos, et al.The Journal of Chemical Physics|April 5, 2014
L-Asparagine crystals with wide gap semiconductor features: optical absorption measurements and density functional theory computationsG Zanatta, C Gottfried, A M Silva, et al.Langmuir : the ACS Journal of Surfaces and Colloids|February 26, 2009
Defects in graphene-based twisted nanoribbons: structural, electronic, and optical propertiesE W S Caetano, V N Freire, S G dos Santos, et al.The Journal of Physical Chemistry. A|September 19, 2018
Vibrational Modes and Phonon and Thermodynamic Properties of the Metaboric Acid Polymorphs α-, β-, and γ-(BOH)M Bezerra da Silva, R C R Santos, J S Rodríguez Hernández, et al.The Journal of Physical Chemistry. A|January 13, 2018
Vibrational Properties of Bulk Boric Acid 2A and 3T Polymorphs and Their Two-Dimensional Layers: Measurements and Density Functional Theory CalculationsM Bezerra da Silva, R C R Santos, P T C Freire, et al.Journal of Physics. Condensed Matter : an Institute of Physics Journal|March 16, 2011
Structural, electronic and optical properties of ilmenite and perovskite CdSnO3 from DFT calculationsP D Sesion, J M Henriques, C A Barboza, et al.The Journal of Chemical Physics|May 10, 2011
Anhydrous crystals of DNA bases are wide gap semiconductorsF F Maia, V N Freire, E W S Caetano, et al.The Journal of Physical Chemistry. B|October 23, 2008
Adsorption of ascorbic acid on the C60 fullereneS G Santos, J V Santana, F F Maia, et al.Nanotechnology|September 3, 2009
C60-derived nanobaskets: stability, vibrational signatures, and molecular trappingS G dos Santos, M S Pires, V Lemos, et al.Journal of Molecular Modeling|May 1, 2021
Computational structural, electronic and optical properties of the palmitic acid in its C formJ G S Santos, A Macedo-Filho, A M Silva, et al.Pageof 2