Synthesis, Characterization and Molecular Modeling of Novel Oxoethyl methacrylate Polymers. [PDF]
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Ab Initio Study of Formation Mechanisms and Thermochemical Properties of Reactive Oxygen Species (ROS) in Photocatalytic Processes. [PDF]
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Antioxidant activity at the molecular level: exploring ways of action and computational tools to investigate them. [PDF]
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Correlated Molecular Orbital Theory Predictions of Hydrogen-Containing Halomethane Thermochemistry: Heats of Formation, C-H Bond Dissociation Energies, and p<i>K</i><sub>a</sub> Values. [PDF]
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Anionic Reactions Degrading SF6 Using Metals: Insights From the Gas Phase. [PDF]
Joshi S, Barden S, Mayer PM.
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Charge-transfer interactions govern the trans influence and electron-induced bond activation in linear Au(i) complexes. [PDF]
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Morphology Effects on Free Energies of Proton-Coupled Electron Transfer in Polyoxotungstates. [PDF]
Towarnicky A +3 more
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Quantum Chemical Studies on the Prototropic and Acid/Base Equilibria for 2-Aminopyrrole in Vacuo-Role of CH Tautomers in the Design of Strong Brønsted Imino N-Bases. [PDF]
Raczyńska ED, Maria PC, Gal JF.
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