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Synthesis, structure-activity relationship and evaluation of new non-polymeric chemical additives based on naphthoquinone derivatives as wax precipitation inhibitors and pour point depressants to petroleum Lemos BC, Gilles V, Goncalves GR, de Castro EVR, Delarmelina M, Carneiro JWD, Greco SJ Fuel, 220, 200, 2018 |
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Adsorption of Bitumen Model Compounds on Kaolinite in Liquid and Supercritical Carbon Dioxide Solvents: A Study by Periodic Density Functional Theory and Molecular Theory of Solvation Lage MR, Stoyanov SR, Carneiro JWD, Dabros T, Kovalenko A Energy & Fuels, 29(5), 2853, 2015 |
3 |
Computational Study of the Effect of Dispersion Interactions on the Thermochemistry of Aggregation of Fused Polycyclic Aromatic Hydrocarbons as Model Asphaltene Compounds in Solution da Costa LM, Stoyanov SR, Gusarov S, Seidl PR, Carneiro JWD, Kovalenko A Journal of Physical Chemistry A, 118(5), 896, 2014 |
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Density Functional Theory Investigation of the Contributions of pi-pi Stacking and Hydrogen-Bonding Interactions to the Aggregation of Model Asphaltene Compounds da Costa LM, Stoyanov SR, Gusarov S, Tan XL, Gray MR, Stryker JM, Tykwinski R, Carneiro JWD, Seidl PR, Kovalenko A Energy & Fuels, 26(5), 2727, 2012 |
5 |
Solvent assisted decomposition of the tetrahedral intermediate of the transesterification reaction to biodiesel production. A density functional study de Lima EF, Carneiro JWD, Fenollar-Ferrer C, Miertus S, Zinoviev S, Tapanes NCO, Aranda DAG Fuel, 89(3), 685, 2010 |
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Transesterification of Jatropha curcas oil glycerides: Theoretical and experimental studies of biodiesel reaction Tapanes NCO, Aranda DAG, Carneiro JWD, Antunes OAC Fuel, 87(10-11), 2286, 2008 |
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Experimental and theoretical studies on glucose hydrogenation to produce sorbitol Castoldi MC, Camaraa LDT, Monteiro RS, Constantino AM, Camacho L, Carneiro JWD, Aranda DG Reaction Kinetics and Catalysis Letters, 91(2), 341, 2007 |
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The interaction between amines and methyl pyruvate involving protonated species Carneiro JWD, de Oliveira CD, Passos FB, Aranda DAG, Rogerio P, de Souza PRN, Antunes OAC Catalysis Today, 107-08, 31, 2005 |
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Interpretation of conformational effects on 2-endo-norborneol by natural chemical shielding analysis Seidl PR, Carneiro JWD, Tostes JGR, Koch A, Kleinpeter E Journal of Physical Chemistry A, 109(5), 802, 2005 |
10 |
Unified mechanistic concept of electrophilic aromatic nitration: Convergence of computational results and experimental data Esteves PM, Carneiro JWD, Cardoso SP, Barbosa AGH, Laali KK, Rasul G, Prakash GKS, Olah GA Journal of the American Chemical Society, 125(16), 4836, 2003 |