Publications

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2020
Chen, M, Christmann AM, Muniz AR, Ramasubramaniam A, Maroudas D.  2020.  Molecular-Dynamics Analysis of Nanoindentation of Graphene Nanomeshes: Implications for 2D Mechanical Metamaterials. ACS Applied Nano Materials. (under review)(x):x-x.
Pinho, JM, Muniz AR.  2020.  PMLES: A Hybrid Open MP CUDA Source Code for LES of Turbulent Flows. Journal of Applied Fluid Mechanics. 13(4):1067-1079.
Miliante, CM, Christmann AM, Usuda EO, Imamura W, Paixão LS, Carvalho AMG, Muniz AR.  2020.  Unveiling the Origin of the Giant Barocaloric Effect in Natural Rubber. Macromolecules. (accepted)(x):x-x.
2019
Silveira, JFRV, Muniz AR.  2019.  Chain- and Chainmail-like Nanostructures from Carbon Nanotube Rings. Computational Materials Science. 161:76-82.
Demingos, P, Muniz AR.  2019.  Electronic and Mechanical Properties of Partially Saturated Carbon and Carbon Nitride Nanothreads. The Journal of Physical Chemistry C. 123(6):3886-3891.
Silveira, JFRV, Muniz AR.  2019.  Flexible Carbon Nanothread-based Membranes with Strain-dependent Gas Transport Properties. Journal of Membrane Science. 585:184-190.
Cruz, AAC, Freire RM, Froelich DB, Lima ACA, Muniz AR, Ferreira OP, Fechine PBA.  2019.  Fluorescence Based Platform to Discriminate Protein Using Carbon Quantum Dots. Chemistry Select. 4(19):5619-5627.
Maroudas, D, Muniz AR, Ramasubramaniam A.  2019.  Structure-Properties Relations in Graphene Derivatives and Metamaterials Obtained by Atomic-Scale Modeling. Molecular Simulation. 45(14-15):1173-1202.
2018
Demingos, PG, Muniz AR.  2018.  Carbon nanothreads from polycyclic aromatic hydrocarbon molecules. Carbon. 140:644-652.
Silveira, JFRV, Muniz AR.  2018.  Diamond nanothread-based 2D and 3D materials: Diamond nanomeshes and nanofoams. Carbon. 139:789-800.
Chen, M, Muniz AR, Maroudas D.  2018.  Formation and Mechanical Behavior of Nanocomposite Superstructures from Interlayer Bonding in Twisted Bilayer Graphene. ACS Applied Materials & Interfaces. 10:28898−28908.
Silveira, JFRV, Pagnusatti RA, Kleinpaul J, Paupitz R, Muniz AR.  2018.  Nanoporous Carbon Superstructures based on Covalent Bonding of Porous Fullerenes. Carbon. 130:424-432.
Ferrarini, F, Flores GB, Muniz AR, Soares RP.  2018.  An open and extensible sigma‐profile database for COSMO‐based models. AIChE Journal. 64(9):3443-3455.
Silva, AF, Christmann AM, Muniz AR, Balzaretti NM.  2018.  Thermal annealing of graphite oxide under high pressure: an experimental and computational study. Carbon. 139:1035-1047.
2017
Hamm, JBS, Muniz AR, Pollo LD, Marcilio NR, Tessaro IC.  2017.  Experimental and computational analysis of carbon molecular sieve membrane formation upon polyetherimide pyrolysis. Carbon. 119:21-29.
Silveira, JFRV, Muniz AR.  2017.  First-principles calculation of the mechanical properties of diamond nanothreads. Carbon. 113:260-265.
Silveira, JFRV, Muniz AR.  2017.  Functionalized diamond nanothreads from benzene derivatives. Physical Chemistry Chemical Physics. 19:7132-7137.
Du, L, Nguyen TN, Gilman A, Muniz AR, Maroudas D.  2017.  Tuning the band structure of graphene nanoribbons through defect-interaction-driven edge patterning. Physical Review B. 96(24):245422.
2016
Carvalho, A, Ordomsky V, Luo Y, Marinova M, Muniz AR, Marcilio NR, Khodakov A.  2016.  Elucidation of deactivation phenomena in cobalt catalyst for Fischer-Tropsch synthesis using SSITKA. Journal of Catalysis. 344:669-679.
Rodrigues, R, Muniz AR, Marcilio NR.  2016.  Evaluation of biomass and coal co-gasification of brazilian feedstock using a chemical equilibrium model. Brazilian Journal of Chemical Engineering. (33):401-414.
Weerasinghe, A, Muniz AR, Ramasubramaniam A, Maroudas D.  2016.  Mechanical properties of hydrogenated electron-irradiated graphene. Journal of Applied Physics. 120:124301.
2015
Muniz, AR, Fonseca AF.  2015.  Carbon-Based Nanostructures Derived from Bilayer Graphene with Zero Thermal Expansion. The Journal of Physical Chemistry C. 119(30):17458–17465.
Hu, L, Wyant S, Muniz AR, Ramasubramaniam A, Maroudas D.  2015.  Mechanical behavior and fracture of graphene nanomeshes. Journal of Applied Physics. 117:024302.
Muniz, AR, Machado AS, Maroudas D.  2015.  Mechanical behavior of interlayer-bonded nanostructures obtained from bilayer graphene. Carbon. 81:663–677.
2014
Ramasubramaniam, A, Muniz AR.  2014.  Ab initio studies of thermodynamic and electronic properties of phosphorene nanoribbons. Physical Review B. 90:085424.