| 1 |
Estimation of Acid Dissociation Constants (pK(a)) of N-Containing Heterocycles in DMSO and Transferability of Gibbs Free Energy in Different Solvent Conditions
Hengphasatporn K, Matsui T, Shigeta Y
Chemistry Letters, 49(3), 307, 2020 |
| 2 |
Quantum chemical investigations of the decomposition of the peroxydisulfate ion to sulfate radicals
Zhang R, Wang XX, Zhou L, Crump D
Chemical Engineering Journal, 361, 960, 2019 |
| 3 |
Initial pyrolysis mechanism of cellulose revealed by in-situ DRIFT analysis and theoretical calculation
Dai GX, Wang KG, Wang GY, Wang SR
Combustion and Flame, 208, 273, 2019 |
| 4 |
Mechanism study on the pyrolysis of the typical ether linkages in biomass
Dai GX, Zhu YN, Yang JZ, Pan Y, Wang GY, Reubroycharoen P, Wang SR
Fuel, 249, 146, 2019 |
| 5 |
1-(2-Hydroxyethyl)-2-imidazolidinone as corrosion inhibitor of mild steel in 0.5 M HCl solution: thermodynamic, electrochemical and theoretical studies
Kelesoglu A, Yildiz R, Dehri I
Journal of Adhesion Science and Technology, 33(18), 2010, 2019 |
| 6 |
Conformational analyses for hydrated oligopeptides by quantum chemical calculation (QCC): effects of intra-molecular hydrogen bonds
Kobayashi M, Sim JH, Sato H
Polymer Bulletin, 76(7), 3247, 2019 |
| 7 |
On the azo dyes derived from benzoic and cinnamic acids used as photosensitizers in dye-sensitized solar cells
Matovic L, Tasic N, Trisovic N, Ladarevic J, Vitnik V, Vitnik Z, Grgur B, Mijin D
Turkish Journal of Chemistry, 43(4), 1183, 2019 |
| 8 |
Tribological behavior and quantum chemical calculations of protic ionic liquids: synthesis, spectroscopic, and thermal properties
Karadag A, Akbas H, Karakas D, Tekin KC, Korkmazer E
Turkish Journal of Chemistry, 43(3), 766, 2019 |
| 9 |
Hydrogen shift isomerizations in the kinetics of the second oxidation mechanism of alkane combustion. Reactions of the hydroperoxypentylperoxy OOQOOH radical
Xing LL, Lucas JW, Wang ZD, Wang XT, Truhlar DG
Combustion and Flame, 197, 88, 2018 |
| 10 |
The influence of electron donating tendency on electrochemical oxidative behavior of hydroquinone: Experimental and theoretical investigations
Nagaraja C, Venkatesha TV
Electrochimica Acta, 260, 221, 2018 |
