Detalhe da pesquisa
1.
Predicting liquid-liquid phase separation in ternary organic-organic-water mixtures.
Phys Chem Chem Phys
; 25(16): 11121-11129, 2023 Apr 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-37017402
2.
Pathways to Highly Oxidized Products in the Δ3-Carene + OH System.
Environ Sci Technol
; 56(4): 2213-2224, 2022 02 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-35119266
3.
Gas-to-Particle Partitioning of Cyclohexene- and α-Pinene-Derived Highly Oxygenated Dimers Evaluated Using COSMOtherm.
J Phys Chem A
; 125(17): 3726-3738, 2021 May 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-33885310
4.
Improving Solubility and Activity Estimates of Multifunctional Atmospheric Organics by Selecting Conformers in COSMOtherm.
J Phys Chem A
; 124(23): 4801-4812, 2020 Jun 11.
Artigo
em Inglês
| MEDLINE | ID: mdl-32420745
5.
Solubility and Activity Coefficients of Atmospheric Surfactants in Aqueous Solution Evaluated Using COSMOtherm.
J Phys Chem A
; 124(2): 430-443, 2020 Jan 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-31829596
6.
Strong Even/Odd Pattern in the Computed Gas-Phase Stability of Dicarboxylic Acid Dimers: Implications for Condensation Thermodynamics.
J Phys Chem A
; 123(44): 9594-9599, 2019 Nov 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-31610657
7.
Computational Comparison of Different Reagent Ions in the Chemical Ionization of Oxidized Multifunctional Compounds.
J Phys Chem A
; 122(1): 269-279, 2018 Jan 11.
Artigo
em Inglês
| MEDLINE | ID: mdl-29200296
8.
Computational Comparison of Acetate and Nitrate Chemical Ionization of Highly Oxidized Cyclohexene Ozonolysis Intermediates and Products.
J Phys Chem A
; 121(10): 2172-2179, 2017 Mar 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-28234483
9.
Computational and Experimental Investigation of the Detection of HO2 Radical and the Products of Its Reaction with Cyclohexene Ozonolysis Derived RO2 Radicals by an Iodide-Based Chemical Ionization Mass Spectrometer.
J Phys Chem A
; 121(36): 6778-6789, 2017 Sep 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-28796517
10.
Cost-Effective Implementation of Multiconformer Transition State Theory for Peroxy Radical Hydrogen Shift Reactions.
J Phys Chem A
; 120(51): 10072-10087, 2016 Dec 29.
Artigo
em Inglês
| MEDLINE | ID: mdl-27992191
11.
Unimolecular HO2 Loss from Peroxy Radicals Formed in Autoxidation Is Unlikely under Atmospheric Conditions.
J Phys Chem A
; 120(20): 3588-95, 2016 May 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-27163880
12.
Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid.
J Phys Chem A
; 119(30): 8414-21, 2015 Jul 30.
Artigo
em Inglês
| MEDLINE | ID: mdl-26154271
13.
Modeling the Charging of Highly Oxidized Cyclohexene Ozonolysis Products Using Nitrate-Based Chemical Ionization.
J Phys Chem A
; 119(24): 6339-45, 2015 Jun 18.
Artigo
em Inglês
| MEDLINE | ID: mdl-26023711
14.
Computational Study of Hydrogen Shifts and Ring-Opening Mechanisms in α-Pinene Ozonolysis Products.
J Phys Chem A
; 119(46): 11366-75, 2015 Nov 19.
Artigo
em Inglês
| MEDLINE | ID: mdl-26529548
15.
Machine Learning for Predicting Chemical Potentials of Multifunctional Organic Compounds in Atmospherically Relevant Solutions.
J Phys Chem Lett
; 13(42): 9928-9933, 2022 Oct 27.
Artigo
em Inglês
| MEDLINE | ID: mdl-36259771
16.
New Particle Formation and Growth from Dimethyl Sulfide Oxidation by Hydroxyl Radicals.
ACS Earth Space Chem
; 5(4): 801-811, 2021 Apr 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-33889792
17.
SO2 formation and peroxy radical isomerization in the atmospheric reaction of OH radicals with dimethyl disulfide.
Chem Commun (Camb)
; 56(88): 13634-13637, 2020 Nov 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-33063068
18.
NH 4 + Association and Proton Transfer Reactions With a Series of Organic Molecules.
Front Chem
; 7: 191, 2019.
Artigo
em Inglês
| MEDLINE | ID: mdl-31001517
19.
The role of highly oxygenated organic molecules in the Boreal aerosol-cloud-climate system.
Nat Commun
; 10(1): 4370, 2019 09 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-31554809
20.
Hydroxyl radical-induced formation of highly oxidized organic compounds.
Nat Commun
; 7: 13677, 2016 12 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-27910849