Year |
Citation |
Score |
2024 |
Xue J, Shao X, Li J, Li J, Trabelsi T, Francisco JS, Zeng X. Observation of the Water-HNSO Complex. Journal of the American Chemical Society. PMID 38359146 DOI: 10.1021/jacs.3c13127 |
0.337 |
|
2024 |
Yuan DF, Liu Y, Trabelsi T, Zhang YR, Li J, Francisco JS, Guo H, Wang LS. Probing the dynamics and bottleneck of the key atmospheric SO oxidation reaction by the hydroxyl radical. Proceedings of the National Academy of Sciences of the United States of America. 121: e2314819121. PMID 38285944 DOI: 10.1073/pnas.2314819121 |
0.314 |
|
2023 |
Esposito VJ, Palmer CZ, Fortenberry RC, Francisco JS. Spectroscopy and Photochemistry of OAlNO and Implications for New Metal Chemistry in the Atmosphere. The Journal of Physical Chemistry. A. PMID 37647609 DOI: 10.1021/acs.jpca.3c04437 |
0.577 |
|
2023 |
Trabelsi T, Francisco JS. Spectroscopic characterization of [H, Cl, S, O] molecular system: Potential candidate for detection in Venus atmosphere. The Journal of Chemical Physics. 158. PMID 37129141 DOI: 10.1063/5.0146450 |
0.309 |
|
2023 |
Sun J, Zhang X, Du S, Pu J, Wang Y, Yuan Y, Qian L, Francisco JS. Charge Density Evolution Governing Interfacial Friction. Journal of the American Chemical Society. PMID 36811399 DOI: 10.1021/jacs.3c00335 |
0.41 |
|
2023 |
Li X, Lu B, Jiang J, Wang L, Trabelsi T, Francisco JS, Fang W, Zhou M, Zeng X. Water Complex of Imidogen. Journal of the American Chemical Society. PMID 36633923 DOI: 10.1021/jacs.2c12808 |
0.43 |
|
2022 |
Wu Z, Shao X, Zhu B, Wang L, Lu B, Trabelsi T, Francisco JS, Zeng X. Spectroscopic characterization of two peroxyl radicals during the O-oxidation of the methylthio radical. Communications Chemistry. 5: 19. PMID 36697894 DOI: 10.1038/s42004-022-00637-z |
0.301 |
|
2022 |
Li B, Kumar M, Zhou C, Li L, Francisco JS. Mechanistic Insights into Criegee Intermediate-Hydroperoxyl Radical Chemistry. Journal of the American Chemical Society. PMID 35921588 DOI: 10.1021/jacs.2c05346 |
0.305 |
|
2022 |
Yuan DF, Trabelsi T, Zhang YR, Francisco JS, Wang LS. Probing the Electronic Structure and Bond Dissociation of SO and SO Using High-Resolution Cryogenic Photoelectron Imaging. Journal of the American Chemical Society. 144: 13740-13747. PMID 35857818 DOI: 10.1021/jacs.2c04698 |
0.442 |
|
2022 |
Sun J, Cheng Z, Huang Q, He H, Francisco JS, Du S. Universal Principle for Large-Scale Production of a High-Quality Two-Dimensional Monolayer via Positive Charge-Driven Exfoliation. The Journal of Physical Chemistry Letters. 6597-6603. PMID 35833746 DOI: 10.1021/acs.jpclett.2c01403 |
0.376 |
|
2022 |
Palmer CZ, Fortenberry RC, Francisco JS. Spectral Signatures of Hydrogen Thioperoxide (HOSH) and Hydrogen Persulfide (HSSH): Possible Molecular Sulfur Sinks in the Dense ISM. Molecules (Basel, Switzerland). 27. PMID 35630675 DOI: 10.3390/molecules27103200 |
0.574 |
|
2022 |
Hansen AS, Qian Y, Sojdak CA, Kozlowski MC, Esposito VJ, Francisco JS, Klippenstein SJ, Lester MI. Rapid Allylic 1,6 H-Atom Transfer in an Unsaturated Criegee Intermediate. Journal of the American Chemical Society. 144: 5945-5955. PMID 35344666 DOI: 10.1021/jacs.2c00055 |
0.325 |
|
2021 |
Lu B, Trabelsi T, Esposito VJ, Fortenberry RC, Francisco JS, Zeng X. Spectroscopic Characterization of HSO and HOSO Intermediates Involved in SO Geoengineering. The Journal of Physical Chemistry. A. 125: 10615-10621. PMID 34890193 DOI: 10.1021/acs.jpca.1c09311 |
0.559 |
|
2021 |
Fortenberry RC, Francisco JS. Anharmonic fundamental vibrational frequencies and spectroscopic constants of the potential HSO radical astromolecule. The Journal of Chemical Physics. 155: 114301. PMID 34551550 DOI: 10.1063/5.0062560 |
0.582 |
|
2021 |
Wei B, Fu Z, Legut D, Germann TC, Du S, Zhang H, Francisco JS, Zhang R. Rational Design of Highly Stable and Active MXene-Based Bifunctional ORR/OER Double-Atom Catalysts. Advanced Materials (Deerfield Beach, Fla.). e2102595. PMID 34342921 DOI: 10.1002/adma.202102595 |
0.395 |
|
2020 |
Fortenberry RC, Trabelsi T, Francisco JS. Anharmonic Frequencies and Spectroscopic Constants of OAlOH and AlOH: Strong Bonding but Unhindered Motion. The Journal of Physical Chemistry. A. PMID 33044814 DOI: 10.1021/acs.jpca.0c07945 |
0.595 |
|
2020 |
Chen T, Wan Z, Trabelsi T, Zhu C, Francisco JS. Mechanisms of Acid-Promoted N2 and N2O Generation from NH2NO and NH2NO2. The Journal of Physical Chemistry. A. PMID 32806894 DOI: 10.1021/Acs.Jpca.0C06417 |
0.396 |
|
2020 |
Burkholder JB, Marshall P, Bera PP, Francisco JS, Lee TJ. Climate Metrics for C1-C4 Hydrofluorocarbons (HFCs). The Journal of Physical Chemistry. A. PMID 32392415 DOI: 10.1021/Acs.Jpca.0C02679 |
0.45 |
|
2020 |
Trabelsi T, Francisco JS. Spectroscopic characterization of the first excited state and photochemistry of the HO radical. The Journal of Chemical Physics. 152: 064304. PMID 32061237 DOI: 10.1063/1.5134838 |
0.304 |
|
2020 |
Bai X, Zha XH, Qiao Y, Qiu N, Zhang Y, Luo K, He J, Li Q, Huang Q, Francisco JS, Lin CT, Du S. Two-dimensional semiconducting LuCT (T = F, OH) MXene with low work function and high carrier mobility. Nanoscale. PMID 31994570 DOI: 10.1039/C9Nr10806H |
0.417 |
|
2020 |
Yu X, Liu Y, Du S, Zheng X, Zhu J, Xu H, Zhang J, Du S, Zeng X, Francisco JS, Jin C, Zhao Y, Li H. CH4 Gas Extraction by CO2: Substitution in Clathrate Hydrate through Bimolecular Iteration Chinese Physics Letters. 37: 048201. DOI: 10.1088/0256-307X/37/4/048201 |
0.475 |
|
2019 |
Trabelsi T, Davis MC, Fortenberry RC, Francisco JS. Spectroscopic investigation of [Al,N,C,O] refractory molecules. The Journal of Chemical Physics. 151: 244303. PMID 31893878 DOI: 10.1063/1.5125268 |
0.608 |
|
2019 |
Li Y, Lu J, Li M, Chang K, Zha X, Zhang Y, Chen K, Persson POÅ, Hultman L, Eklund P, Du S, Francisco JS, Chai Z, Huang Z, Huang Q. Multielemental single-atom-thick layers in nanolaminated V(Sn, ) C ( = Fe, Co, Ni, Mn) for tailoring magnetic properties. Proceedings of the National Academy of Sciences of the United States of America. PMID 31879341 DOI: 10.1073/Pnas.1916256117 |
0.394 |
|
2019 |
Yang J, Li L, Shixian W, Li H, Francisco JS, Zeng XC, Gao Y. Unraveling a New Chemical Mechanism of Missing Sulfate Formation in Aerosol Haze : Gaseous NO2 with aqueous HSO3-/SO32. Journal of the American Chemical Society. PMID 31722172 DOI: 10.1021/Jacs.9B08503 |
0.309 |
|
2019 |
Fu Z, Wang N, Legut D, Si C, Zhang Q, Du S, Germann TC, Francisco JS, Zhang R. Rational Design of Flexible Two-Dimensional MXenes with Multiple Functionalities. Chemical Reviews. PMID 31710485 DOI: 10.1021/Acs.Chemrev.9B00348 |
0.405 |
|
2019 |
Fortenberry RC, Trabelsi T, Westbrook BR, Del Rio WA, Francisco JS. Molecular oxygen generation from the reaction of water cations with oxygen atoms. The Journal of Chemical Physics. 150: 201103. PMID 31153175 DOI: 10.1063/1.5102073 |
0.584 |
|
2019 |
Anglada JM, Martins-Costa MTC, Francisco JS, Ruiz-López MF. Triplet state promoted reaction of SO with HO by competition between proton coupled electron transfer (pcet) and hydrogen atom transfer (hat) processes. Physical Chemistry Chemical Physics : Pccp. PMID 31025661 DOI: 10.1039/C9Cp01105F |
0.308 |
|
2019 |
Hoehn RD, Francisco JS, Kais S, Kachmar A. Role of Water on the Rotational Dynamics of the Organic Methylammonium Cation: A First Principles Analysis. Scientific Reports. 9: 668. PMID 30679543 DOI: 10.1038/S41598-018-36900-4 |
0.373 |
|
2018 |
Fu Z, Zhang S, Legut D, Germann TC, Si C, Du S, Francisco JS, Zhang R. A synergetic stabilization and strengthening strategy for two-dimensional ordered hybrid transition metal carbides. Physical Chemistry Chemical Physics : Pccp. PMID 30475359 DOI: 10.1039/C8Cp06458J |
0.41 |
|
2018 |
Westbrook BR, Dreux KM, Tschumper GS, Francisco JS, Fortenberry RC. Binding of the atomic cations hydrogen through argon to water and hydrogen sulfide. Physical Chemistry Chemical Physics : Pccp. PMID 30298145 DOI: 10.1039/C8Cp05378B |
0.577 |
|
2018 |
Martins-Costa MTC, Anglada JM, Francisco JS, Ruiz-Lopez MF. Photochemistry of SO at the air-water interface. A source of OH and HOSO radicals. Journal of the American Chemical Society. PMID 30226769 DOI: 10.1021/Jacs.8B07845 |
0.411 |
|
2018 |
Trabelsi T, Al-Mogren MM, Hochlaf M, Francisco JS. Mechanistic study of the photoexcitation, photoconversion, and photodissociation of CS. The Journal of Chemical Physics. 149: 064304. PMID 30111147 DOI: 10.1063/1.5040141 |
0.342 |
|
2018 |
Li H, Zhong J, Vehkamaki H, Kurtén T, Wang W, Ge M, Zhang S, Li Z, Zhang X, Francisco JS, Zeng XC. Self-Catalytic Reaction of SO3 and NH3 to Produce Sulfamic Acid and Its Implication to Atmospheric Particle Formation. Journal of the American Chemical Society. PMID 30088767 DOI: 10.1021/Jacs.8B04928 |
0.344 |
|
2018 |
Wu Z, Song C, Liu J, Lu B, Lu Y, Trabelsi T, Francisco JS, Zeng X. Photochemistry of OPN: Formation of Cyclic PON and Reversible Combination with Carbon Monoxide. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 29978924 DOI: 10.1002/Chem.201803383 |
0.301 |
|
2018 |
Kumar M, Zhong J, Zeng XC, Francisco JS. Criegee intermediate inside fullerene cage: Evidence for size-dependent reactivity. The Journal of Chemical Physics. 148: 244301. PMID 29960314 DOI: 10.1063/1.5024786 |
0.33 |
|
2018 |
Arathala P, Kumar M, Francisco JS, Sinha A. Organic Acid Formation from the Atmospheric Oxidation of Gem Diols: Reaction Mechanism, Energetics, and Rates. The Journal of Physical Chemistry. A. PMID 29957938 DOI: 10.1021/Acs.Jpca.8B01773 |
0.454 |
|
2018 |
Li L, Duan Z, Li H, Zhu C, Henkelman G, Francisco JS, Zeng XC. Formation of HONO from the NH-promoted hydrolysis of NO dimers in the atmosphere. Proceedings of the National Academy of Sciences of the United States of America. PMID 29941594 DOI: 10.1073/Pnas.1807719115 |
0.421 |
|
2018 |
Fu Z, Legut D, Germann TC, Si C, Du S, Francisco JS, Zhang R. Phonon-mediated stabilization and softening of 2D transition metal carbides: case studies of TiCO and MoCO. Physical Chemistry Chemical Physics : Pccp. PMID 29766161 DOI: 10.1039/C8Cp00752G |
0.42 |
|
2018 |
Fortenberry RC, Trabelsi T, Francisco JS. Hydrogen Sulfide as a Scavenger of Sulfur Atomic Cation. The Journal of Physical Chemistry. A. PMID 29750523 DOI: 10.1021/Acs.Jpca.8B02923 |
0.595 |
|
2018 |
Trabelsi T, Hochlaf M, Francisco JS. Toward the detection of the triatomic negative ion SPN: Spectroscopy and potential energy surfaces. The Journal of Chemical Physics. 148: 164305. PMID 29716237 DOI: 10.1063/1.5029275 |
0.374 |
|
2018 |
Zha XH, Ren JC, Feng L, Bai X, Luo K, Zhang Y, He J, Huang Q, Francisco JS, Du S. Bipolar magnetic semiconductors among intermediate states during the conversion from ScC(OH) to ScCO MXene. Nanoscale. PMID 29708262 DOI: 10.1039/C8Nr01292J |
0.466 |
|
2018 |
Kumar M, Li H, Zhang X, Zeng XC, Francisco JS. Nitric Acid-Amine Chemistry in the Gas Phase and at the Air-Water Interface. Journal of the American Chemical Society. PMID 29689155 DOI: 10.1021/Jacs.8B03300 |
0.301 |
|
2018 |
Zhong J, Kumar M, Francisco JS, Zeng XC. Insight into Chemistry on Cloud/Aerosol Water Surfaces. Accounts of Chemical Research. PMID 29633837 DOI: 10.1021/Acs.Accounts.8B00051 |
0.372 |
|
2018 |
Dong X, Deng G, Wu Z, Xu J, Lu B, Trabelsi T, Francisco JS, Zeng X. Spectroscopic Identification of H2NSO and syn- and anti-HNSOH Radicals. Angewandte Chemie (International Ed. in English). PMID 29578623 DOI: 10.1002/Anie.201802738 |
0.347 |
|
2018 |
Kumar M, Zhong J, Zeng XC, Francisco JS. Reaction of Criegee Intermediate with Nitric Acid at the Air-Water Interface. Journal of the American Chemical Society. PMID 29564890 DOI: 10.1021/Jacs.8B01191 |
0.38 |
|
2018 |
Kumar M, Trabelsi T, Francisco JS. Can Urea Be a Seed for Aerosol Particle Formation in Air? The Journal of Physical Chemistry. A. PMID 29522335 DOI: 10.1021/Acs.Jpca.8B02189 |
0.339 |
|
2018 |
Cheraki M, Al-Mogren MM, Chambaud G, Francisco JS, Hochlaf M. On the Identification of Key Intermediates During the NO and HS Crosstalk Signaling Pathways. The Journal of Physical Chemistry. A. PMID 29488763 DOI: 10.1021/Acs.Jpca.7B11821 |
0.363 |
|
2018 |
Trabelsi T, Al Mogren MM, Hochlaf M, Francisco JS. Electronic and spectroscopic characterizations of SNP isomers. The Journal of Chemical Physics. 148: 054305. PMID 29421883 DOI: 10.1063/1.5013208 |
0.333 |
|
2018 |
Anglada JM, Crehuet R, Adhikari S, Francisco JS, Xia Y. Reactivity of hydropersulfides toward the hydroxyl radical unraveled: disulfide bond cleavage, hydrogen atom transfer, and proton-coupled electron transfer. Physical Chemistry Chemical Physics : Pccp. PMID 29383342 DOI: 10.1039/C7Cp07570G |
0.408 |
|
2018 |
Wu Z, Feng R, Xu J, Lu Y, Lu B, Yang T, Frenking G, Trabelsi T, Francisco JS, Zeng X. Photoinduced Sulfur-Nitrogen Bond Rotation and Thermal Nitrogen Inversion in Heterocumulene OSNSO. Journal of the American Chemical Society. PMID 29307182 DOI: 10.1021/Jacs.7B12622 |
0.316 |
|
2018 |
Trabelsi T, Francisco JS. Is AlOH the Astrochemical Reservoir Molecule of AlO?: Insights from Excited Electronic States The Astrophysical Journal. 863: 139. DOI: 10.3847/1538-4357/Aad5E0 |
0.357 |
|
2018 |
Fortenberry RC, Francisco JS. A Possible Progenitor of the Interstellar Sulfide Bond: Rovibrational Characterization of the Hydrogen Disulfide Cation HSSH+ The Astrophysical Journal. 856: 30. DOI: 10.3847/1538-4357/Aab3D6 |
0.565 |
|
2018 |
Xu J, Zhu C, Wang Y, Li H, Huang Y, Shen Y, Francisco JS, Zeng XC, Meng S. Water transport through subnanopores in the ultimate size limit: Mechanism from molecular dynamics Nano Research. 12: 587-592. DOI: 10.1007/S12274-018-2258-7 |
0.305 |
|
2017 |
Zhang H, Fu Z, Zhang R, Zhang Q, Tian H, Legut D, Germann TC, Guo Y, Du S, Francisco JS. Designing flexible 2D transition metal carbides with strain-controllable lithium storage. Proceedings of the National Academy of Sciences of the United States of America. PMID 29229853 DOI: 10.1073/Pnas.1717219115 |
0.421 |
|
2017 |
Martins-Costa MTC, Anglada JM, Francisco JS, Ruiz-López MF. Impacts of cloud water droplets on the OH production rate from peroxide photolysis. Physical Chemistry Chemical Physics : Pccp. 19: 31621-31627. PMID 29164201 DOI: 10.1039/C7Cp06813A |
0.34 |
|
2017 |
Kumar M, Francisco JS. H-X (X=H, CH3, CH2F, CHF2, CF3, and SiH3) Bond Activation by Criegee Intermediates: A Theoretical Perspective. The Journal of Physical Chemistry. A. PMID 29160705 DOI: 10.1021/Acs.Jpca.7B10535 |
0.387 |
|
2017 |
Trabelsi T, Kumar M, Francisco JS. Substituent effects on the spectroscopic properties of Criegee intermediates. The Journal of Chemical Physics. 147: 164303. PMID 29096470 DOI: 10.1063/1.4998170 |
0.389 |
|
2017 |
Zhong J, Zhu C, Li L, Richmond GL, Francisco JS, Zeng XC. Interaction of SO2 with the Surface of Water Nanodroplet. Journal of the American Chemical Society. PMID 29083178 DOI: 10.1021/Jacs.7B09900 |
0.343 |
|
2017 |
Parandaman A, Tangtartharakul CB, Kumar M, Francisco JS, Sinha A. A Computational Study Investigating the Energetics and Kinetics of the HNCO + (CH3)2NH Reaction Catalyzed by a Single Water Molecule. The Journal of Physical Chemistry. A. PMID 29035060 DOI: 10.1021/Acs.Jpca.7B08657 |
0.428 |
|
2017 |
Trabelsi T, Kumar M, Francisco JS. How Does the Central Atom Substitution Impact the Properties of Criegee Intermediate? Insights from Multi-Reference Calculations. Journal of the American Chemical Society. PMID 29023119 DOI: 10.1021/Jacs.7B08412 |
0.374 |
|
2017 |
Fortenberry RC, Francisco JS, Lee TJ. Quantum Chemical Rovibrational Analysis of the HOSO Radical. The Journal of Physical Chemistry. A. PMID 28972756 DOI: 10.1021/Acs.Jpca.7B08121 |
0.699 |
|
2017 |
Kumar M, Zhong J, Francisco JS, Zeng XC. Criegee intermediate-hydrogen sulfide chemistry at the air/water interface. Chemical Science. 8: 5385-5391. PMID 28970917 DOI: 10.1039/C7Sc01797A |
0.373 |
|
2017 |
Artiglia L, Edebeli J, Orlando F, Chen S, Lee MT, Corral Arroyo P, Gilgen A, Bartels-Rausch T, Kleibert A, Vazdar M, Andres Carignano M, Francisco JS, Shepson PB, Gladich I, Ammann M. A surface-stabilized ozonide triggers bromide oxidation at the aqueous solution-vapour interface. Nature Communications. 8: 700. PMID 28951540 DOI: 10.1038/S41467-017-00823-X |
0.365 |
|
2017 |
Fortenberry RC, Thackston R, Francisco JS, Lee TJ. Toward the laboratory identification of the not-so-simple NS2 neutral and anion isomers. The Journal of Chemical Physics. 147: 074303. PMID 28830189 DOI: 10.1063/1.4985901 |
0.699 |
|
2017 |
Kumar M, Francisco JS. Reactions of Criegee Intermediates with Non-Water Greenhouse Gases: Implications For Metal Free Chemical Fixation of Carbon Dioxide. The Journal of Physical Chemistry Letters. PMID 28825826 DOI: 10.1021/Acs.Jpclett.7B01762 |
0.313 |
|
2017 |
Kumar M, Francisco JS. A Coupled Cluster Investigation of SNO Radical Isomers and Their Reactions with Hydrogen Atom: Insight into Structures, Conformers, Barriers, and Energetics. The Journal of Physical Chemistry. A. PMID 28816457 DOI: 10.1021/Acs.Jpca.7B06344 |
0.454 |
|
2017 |
Kumar M, Anglada JM, Francisco JS. Role of Proton Tunneling and Metal Free Organocatalysis in Decomposition of Methanediol: A Theoretical Study. The Journal of Physical Chemistry. A. PMID 28513154 DOI: 10.1021/Acs.Jpca.7B01864 |
0.374 |
|
2017 |
Bonnet L, Linguerri R, Hochlaf M, Yazidi O, Halvick P, Francisco JS. Full-Dimensional Theory of Pair-Correlated HNCO Photofragmentation. The Journal of Physical Chemistry Letters. PMID 28498666 DOI: 10.1021/Acs.Jpclett.7B00920 |
0.315 |
|
2017 |
Zhong J, Kumar M, Zhu CQ, Francisco JS, Zeng XC. Surprising Stability of Larger Criegee Intermediates on Aqueous Interfaces. Angewandte Chemie (International Ed. in English). PMID 28471069 DOI: 10.1002/Anie.201702722 |
0.363 |
|
2017 |
Anglada JM, Crehuet R, Martins-Costa M, Francisco JS, Ruiz-López M. The atmospheric oxidation of CH3OOH by the OH radical: the effect of water vapor. Physical Chemistry Chemical Physics : Pccp. PMID 28453016 DOI: 10.1039/C7Cp01976A |
0.466 |
|
2017 |
Zha XH, Zhou J, Luo K, Lang J, Huang Q, Zhou X, Francisco J, He J, Du S. Controllable magnitude and anisotropy of the electrical conductivity of Hf3C2O2 MXene. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 28234238 DOI: 10.1088/1361-648X/Aa62Da |
0.369 |
|
2017 |
Ayari T, Hochlaf M, Mogren Al-Mogren M, Francisco JS. Characterization of the electronic states of the biological relevant SSNO molecule. The Journal of Chemical Physics. 146: 074301. PMID 28228028 DOI: 10.1063/1.4975989 |
0.336 |
|
2017 |
Kumar M, Francisco JS. Elemental sulfur aerosol-forming mechanism. Proceedings of the National Academy of Sciences of the United States of America. PMID 28096368 DOI: 10.1073/Pnas.1620870114 |
0.364 |
|
2017 |
Perez JE, Kumar M, Francisco JS, Sinha A. Oxygenate-Induced Tuning of Aldehyde-Amine Reactivity and its Atmospheric Implications. The Journal of Physical Chemistry. A. PMID 28071913 DOI: 10.1021/Acs.Jpca.6B10845 |
0.408 |
|
2017 |
Smith MC, Chao W, Kumar M, Francisco JS, Takahashi K, Lin JJ. Temperature-Dependent Rate Coefficients for the Reaction of CH2OO with Hydrogen Sulfide. The Journal of Physical Chemistry. A. PMID 28067517 DOI: 10.1021/Acs.Jpca.6B12303 |
0.372 |
|
2017 |
Fortenberry RC, Francisco JS. Bridged HPSi and Linear HSiP as Probes of the SiP Radical in Astrophysical/Interstellar Media The Astrophysical Journal. 843: 124. DOI: 10.3847/1538-4357/Aa7679 |
0.637 |
|
2017 |
Fortenberry RC, Francisco JS. On the Detectability of the ${\tilde{{\boldsymbol{X}}}}^{2}{\boldsymbol{A}}^{\prime\prime} $ HSS, HSO, and HOS Radicals in the Interstellar Medium The Astrophysical Journal. 835: 243. DOI: 10.3847/1538-4357/Aa582D |
0.554 |
|
2016 |
Chen Z, Lau KC, Garcia GA, Nahon L, Božanić DK, Poisson L, Al-Mogren MM, Schwell M, Francisco JS, Bellili A, Hochlaf M. Identifying Cytosine-Specific Isomers via High-Accuracy Single Photon Ionization. Journal of the American Chemical Society. PMID 27992194 DOI: 10.1021/Jacs.6B10413 |
0.365 |
|
2016 |
Finney B, Mitrushchenkov AO, Francisco JS, Peterson KA. Ab initio ro-vibronic spectroscopy of the Π2 PCS radical and Σ+1PCS(-) anion. The Journal of Chemical Physics. 145: 224303. PMID 27984883 DOI: 10.1063/1.4971183 |
0.325 |
|
2016 |
Francisco JS, Kumar M. Thioaldehydes From Aldehyde-Hydrogen Sulfide Interaction Under Organocatalysis. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 27902861 DOI: 10.1002/Chem.201605080 |
0.37 |
|
2016 |
Anglada JM, Crehuet R, Francisco JS. The Stability of α-Hydroperoxyalkyl Radicals. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 27808436 DOI: 10.1002/Chem.201604499 |
0.41 |
|
2016 |
Finney B, Fortenberry RC, Francisco JS, Peterson KA. A spectroscopic case for SPSi detection: The third-row in a single molecule. The Journal of Chemical Physics. 145: 124311. PMID 27782681 DOI: 10.1063/1.4963337 |
0.605 |
|
2016 |
Kumar M, Francisco JS. Heteroatom Tuning of Bimolecular Criegee Reactions and Its Implications. Angewandte Chemie (International Ed. in English). PMID 27678012 DOI: 10.1002/Anie.201604848 |
0.366 |
|
2016 |
Fortenberry RC, Lee TJ, Francisco JS. Quantum Chemical Analysis of the CO-HNN+ Proton-Bound Complex. The Journal of Physical Chemistry. A. PMID 27643412 DOI: 10.1021/Acs.Jpca.6B07515 |
0.688 |
|
2016 |
Trabelsi T, Ben Yaghlane S, Al Mogren MM, Francisco JS, Hochlaf M. HNS(+) and HSN(+) cations: Electronic states, spin-rovibronic spectroscopy with planetary and biological implications. The Journal of Chemical Physics. 145: 084307. PMID 27586922 DOI: 10.1063/1.4961313 |
0.345 |
|
2016 |
Zhu C, Kumar M, Zhong J, Li L, Francisco JS, Zeng XC. New Mechanistic Pathways for the Criegee-Water Chemistry at the Air/Water Interface. Journal of the American Chemical Society. PMID 27509207 DOI: 10.1021/Jacs.6B04338 |
0.377 |
|
2016 |
Zha XH, Huang Q, He J, He H, Zhai J, Francisco JS, Du S. The thermal and electrical properties of the promising semiconductor MXene Hf2CO2. Scientific Reports. 6: 27971. PMID 27302597 DOI: 10.1038/Srep27971 |
0.384 |
|
2016 |
Hoehn RD, Carignano MA, Kais S, Zhu C, Zhong J, Zeng XC, Francisco JS, Gladich I. Hydrogen bonding and orientation effects on the accommodation of methylamine at the air-water interface. The Journal of Chemical Physics. 144: 214701. PMID 27276960 DOI: 10.1063/1.4950951 |
0.353 |
|
2016 |
Hoehn RD, Yeole SD, Kais S, Francisco JS. Analytic ab initio-based molecular interaction potential for the BrO⋅H2O complex. The Journal of Chemical Physics. 144: 204121. PMID 27250293 DOI: 10.1063/1.4950956 |
0.323 |
|
2016 |
Kumar M, Sinha A, Francisco JS. Role of Double Hydrogen Atom Transfer Reactions in Atmospheric Chemistry. Accounts of Chemical Research. PMID 27074637 DOI: 10.1021/Acs.Accounts.6B00040 |
0.393 |
|
2016 |
He R, Li L, Zhong J, Zhu C, Francisco JS, Zeng XC. Resolving the HONO formation mechanism in the ionosphere via ab initio molecular dynamic simulations. Proceedings of the National Academy of Sciences of the United States of America. PMID 27071120 DOI: 10.1073/Pnas.1601651113 |
0.394 |
|
2016 |
Kumar M, Francisco JS. Red-Light Initiated Decomposition of Hydroxy Methylperoxy Radical in the Presence of Organic and Inorganic Acids: Implications for the HOx Formation in the Lower Stratosphere. The Journal of Physical Chemistry. A. PMID 27070960 DOI: 10.1021/Acs.Jpca.6B01515 |
0.363 |
|
2016 |
Green MC, Dubnicka LJ, Davis AC, Rypkema HA, Francisco JS, Slipchenko LV. Thermodynamics and Kinetics for the Free Radical Oxygen Protein Oxidation Pathway in a Model for β-structured Peptides. The Journal of Physical Chemistry. A. PMID 27055125 DOI: 10.1021/Acs.Jpca.5B12549 |
0.59 |
|
2016 |
Zha XH, Zhou J, Zhou Y, Huang Q, He J, Francisco JS, Luo K, Du S. Promising electron mobility and high thermal conductivity in Sc2CT2 (T = F, OH) MXenes. Nanoscale. PMID 26932122 DOI: 10.1039/C5Nr08639F |
0.411 |
|
2016 |
Li L, Kumar M, Zhu C, Zhong J, Francisco JS, Zeng XC. Near-Barrierless Ammonium Bisulfate Formation via a Loop-Structure Promoted Proton Transfer Mechanism on the Surface of Water. Journal of the American Chemical Society. PMID 26811124 DOI: 10.1021/Jacs.5B13048 |
0.355 |
|
2016 |
Francisco JS, Kumar M. H2S-Induced CO2 Activation via Metal Free Dual Catalysis. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 26781129 DOI: 10.1002/Chem.201504953 |
0.309 |
|
2016 |
Fortenberry RC, Francisco JS, Lee TJ. TOWARD the ASTRONOMICAL DETECTION of the PROTON-BOUND COMPLEX NN-HCO+: IMPLICATIONS for the SPECTRA of PROTOPLANETARY DISKS Astrophysical Journal. 819. DOI: 10.3847/0004-637X/819/2/141 |
0.667 |
|
2016 |
Zha XH, Yin J, Zhou Y, Huang Q, Luo K, Lang J, Francisco JS, He J, Du S. Intrinsic Structural, Electrical, Thermal, and Mechanical Properties of the Promising Conductor Mo2C MXene Journal of Physical Chemistry C. 120: 15082-15088. DOI: 10.1021/Acs.Jpcc.6B04192 |
0.458 |
|
2015 |
Fortenberry RC, Francisco JS. Energetics, structure, and rovibrational spectroscopic properties of the sulfurous anions SNO(-) and OSN(.). The Journal of Chemical Physics. 143: 184301. PMID 26567656 DOI: 10.1063/1.4935056 |
0.622 |
|
2015 |
Kumar M, Francisco JS. Red-Light-Induced Decomposition of an Organic Peroxy Radical: A New Source of the HO2 Radical. Angewandte Chemie (International Ed. in English). PMID 26555823 DOI: 10.1002/Anie.201509311 |
0.397 |
|
2015 |
Yu Q, Bowman JM, Fortenberry RC, Mancini JS, Lee TJ, Crawford TD, Klemperer W, Francisco JS. The Structure, Anharmonic Vibrational Frequencies, and Intensities of NNHNN(.) The Journal of Physical Chemistry. A. PMID 26529262 DOI: 10.1021/Acs.Jpca.5B09682 |
0.734 |
|
2015 |
Louie MK, Francisco JS, Verdicchio M, Klippenstein SJ, Sinha A. Dimethylamine Addition to Formaldehyde Catalyzed by a Single Water Molecule: A Facile Route for Atmospheric Carbinolamine Formation and Potential Promoter of Aerosol Growth. The Journal of Physical Chemistry. A. PMID 26406105 DOI: 10.1021/Acs.Jpca.5B04887 |
0.318 |
|
2015 |
Xu Y, Bai X, Zha X, Huang Q, He J, Luo K, Zhou Y, Germann TC, Francisco JS, Du S. New insight into the helium-induced damage in MAX phase Ti3AlC2 by first-principles studies. The Journal of Chemical Physics. 143: 114707. PMID 26395728 DOI: 10.1063/1.4931398 |
0.503 |
|
2015 |
Kumar M, Francisco JS. The Role of Catalysis in Alkanediol Decomposition: Implications for General Detection of Alkanediols and Their Formation in the Atmosphere. The Journal of Physical Chemistry. A. 119: 9821-33. PMID 26366757 DOI: 10.1021/Acs.Jpca.5B07642 |
0.383 |
|
2015 |
Fortenberry RC, Francisco JS. Quartic force field-derived vibrational frequencies and spectroscopic constants for the isomeric pair SNO and OSN and isotopologues. The Journal of Chemical Physics. 143: 084308. PMID 26328844 DOI: 10.1063/1.4929472 |
0.621 |
|
2015 |
Zhong J, Zhao Y, Li L, Li H, Francisco JS, Zeng XC. Interaction of the NH2 Radical with the Surface of a Water Droplet. Journal of the American Chemical Society. 137: 12070-8. PMID 26325351 DOI: 10.1021/Jacs.5B07354 |
0.391 |
|
2015 |
Fortenberry RC, Yu Q, Mancini JS, Bowman JM, Lee TJ, Crawford TD, Klemperer WF, Francisco JS. Communication: Spectroscopic consequences of proton delocalization in OCHCO(.). The Journal of Chemical Physics. 143: 071102. PMID 26298107 DOI: 10.1063/1.4929345 |
0.748 |
|
2015 |
Anglada JM, Martins-Costa M, Francisco JS, Ruiz-López MF. Interconnection of reactive oxygen species chemistry across the interfaces of atmospheric, environmental, and biological processes. Accounts of Chemical Research. 48: 575-83. PMID 25688469 DOI: 10.1021/Ar500412P |
0.391 |
|
2015 |
Gladich I, Francisco JS, Buszek RJ, Vazdar M, Carignano MA, Shepson PB. Ab initio study of the reaction of ozone with bromide ion. The Journal of Physical Chemistry. A. 119: 4482-8. PMID 25642913 DOI: 10.1021/Jp5101279 |
0.771 |
|
2015 |
Farahani P, Maeda S, Francisco JS, Lundberg M. Mechanisms for the breakdown of halomethanes through reactions with ground-state cyano radicals. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 16: 181-90. PMID 25263486 DOI: 10.1002/cphc.201402601 |
0.309 |
|
2015 |
Luo K, Deng Q, Zha X, Huang Q, Francisco JS, Yu X, Qiao Y, He J, Du S. Electronic structures and mechanical properties of Al(111)/ZrB2(0001) heterojunctions from first-principles calculation Molecular Physics. DOI: 10.1080/00268976.2015.1014441 |
0.427 |
|
2015 |
Zhao WH, Bai J, Wang L, Yuan LF, Yang J, Francisco JS, Zeng XC. Formation of bilayer clathrate hydrates Journal of Materials Chemistry A. 3: 5547-5555. DOI: 10.1039/C4Ta06857B |
0.36 |
|
2015 |
Khan MAH, Cooke MC, Utembe SR, Archibald AT, Derwent RG, Jenkin ME, Morris WC, South N, Hansen JC, Francisco JS, Percival CJ, Shallcross DE. Global analysis of peroxy radicals and peroxy radical-water complexation using the STOCHEM-CRI global chemistry and transport model Atmospheric Environment. 106: 278-287. DOI: 10.1016/J.Atmosenv.2015.02.020 |
0.58 |
|
2015 |
Kumar M, Francisco JS. Inside Back Cover: Red‐Light‐Induced Decomposition of an Organic Peroxy Radical: A New Source of the HO2 Radical (Angew. Chem. Int. Ed. 52/2015) Angewandte Chemie. 54: 15915-15915. DOI: 10.1002/Anie.201511091 |
0.327 |
|
2015 |
Kumar M, Francisco JS. Innenrücktitelbild: Red‐Light‐Induced Decomposition of an Organic Peroxy Radical: A New Source of the HO2 Radical (Angew. Chem. 52/2015) Angewandte Chemie. 127: 16145-16145. DOI: 10.1002/Ange.201511091 |
0.325 |
|
2014 |
Tan L, Ture?ek F, Francisco JS, Xia Y. Probing the radical and base dual properties of peptide sulfinyl radicals via mass spectrometry. The Journal of Physical Chemistry. A. 118: 11828-35. PMID 25428214 DOI: 10.1021/Jp510362P |
0.359 |
|
2014 |
Davis AC, Francisco JS. Hydroxyalkoxy radicals: importance of intramolecular hydrogen bonding on chain branching reactions in the combustion and atmospheric decomposition of hydrocarbons. The Journal of Physical Chemistry. A. 118: 10982-1001. PMID 25347001 DOI: 10.1021/Jp506436G |
0.619 |
|
2014 |
Yu X, Zhu J, Du S, Xu H, Vogel SC, Han J, Germann TC, Zhang J, Jin C, Francisco JS, Zhao Y. Crystal structure and encapsulation dynamics of ice II-structured neon hydrate. Proceedings of the National Academy of Sciences of the United States of America. 111: 10456-61. PMID 25002464 DOI: 10.1073/Pnas.1410690111 |
0.433 |
|
2014 |
Ben Yaghlane S, Jaidane NE, Cotton CE, Francisco JS, Al Mogren MM, Linguerri R, Hochlaf M. Theoretical spectroscopic investigations of HNS(q) and HSN(q) (q = 0, +1, -1) in the gas phase. The Journal of Chemical Physics. 140: 244309. PMID 24985640 DOI: 10.1063/1.4883915 |
0.619 |
|
2014 |
Zhu J, Du S, Yu X, Zhang J, Xu H, Vogel SC, Germann TC, Francisco JS, Izumi F, Momma K, Kawamura Y, Jin C, Zhao Y. Encapsulation kinetics and dynamics of carbon monoxide in clathrate hydrate. Nature Communications. 5: 4128. PMID 24936712 DOI: 10.1038/Ncomms5128 |
0.43 |
|
2014 |
Hazra MK, Francisco JS, Sinha A. Hydrolysis of glyoxal in water-restricted environments: formation of organic aerosol precursors through formic acid catalysis. The Journal of Physical Chemistry. A. 118: 4095-105. PMID 24831426 DOI: 10.1021/Jp502126M |
0.336 |
|
2013 |
Rypkema HA, Francisco JS. Atmospheric oxidation of peroxyacetic acid. The Journal of Physical Chemistry. A. 117: 14151-62. PMID 24279867 DOI: 10.1021/Jp409773J |
0.351 |
|
2013 |
Ben Yaghlane S, Cotton CE, Francisco JS, Linguerri R, Hochlaf M. Ab initio structural and spectroscopic study of HPS(x) and HSP(x) (x = 0,+1,-1) in the gas phase. The Journal of Chemical Physics. 139: 174313. PMID 24206304 DOI: 10.1063/1.4827520 |
0.668 |
|
2013 |
Anglada JM, Hoffman GJ, Slipchenko LV, Costa MM, Ruiz-López MF, Francisco JS. Atmospheric significance of water clusters and ozone-water complexes. The Journal of Physical Chemistry. A. 117: 10381-96. PMID 24028451 DOI: 10.1021/Jp407282C |
0.39 |
|
2013 |
Lu N, Ley RM, Cotton CE, Chung WC, Francisco JS, Negishi E. Molecular tuning of the closed shell C-H···F-C hydrogen bond. The Journal of Physical Chemistry. A. 117: 8256-62. PMID 23909861 DOI: 10.1021/Jp404791G |
0.623 |
|
2013 |
Eric Cotton C, Francisco JS, Klemperer W. Computational study of the linear proton bound ion-molecule complexes of HCNH+ with HCN and HNC. The Journal of Chemical Physics. 139: 014304. PMID 23822300 DOI: 10.1063/1.4811834 |
0.562 |
|
2013 |
Hazra MK, Francisco JS, Sinha A. Gas phase hydrolysis of formaldehyde to form methanediol: impact of formic acid catalysis. The Journal of Physical Chemistry. A. 117: 11704-10. PMID 23614454 DOI: 10.1021/Jp4008043 |
0.401 |
|
2013 |
Love CB, Tan L, Francisco JS, Xia Y. Competition of charge- versus radical-directed fragmentation of gas-phase protonated cysteine sulfinyl radicals. Journal of the American Chemical Society. 135: 6226-33. PMID 23527556 DOI: 10.1021/Ja4008744 |
0.352 |
|
2013 |
Yazidi O, Houria AB, Francisco JS, Hochlaf M. Electronic states, conical intersections, and spin-rovibronic spectroscopy of the nitrogen oxide sulfide radical. The Journal of Chemical Physics. 138: 104318. PMID 23514500 DOI: 10.1063/1.4794313 |
0.364 |
|
2013 |
Cotton CE, Francisco JS, Mitrushchenkov AO. Structural and spectroscopic study of the linear proton-bound complex of PN with HNP+. The Journal of Chemical Physics. 138: 074314. PMID 23445016 DOI: 10.1063/1.4790604 |
0.67 |
|
2013 |
Green MC, Fedorov DG, Kitaura K, Francisco JS, Slipchenko LV. Open-shell pair interaction energy decomposition analysis (PIEDA): formulation and application to the hydrogen abstraction in tripeptides. The Journal of Chemical Physics. 138: 074111. PMID 23445001 DOI: 10.1063/1.4790616 |
0.38 |
|
2013 |
Huang X, Fortenberry RC, Wang Y, Francisco JS, Crawford TD, Bowman JM, Lee TJ. Dipole surface and infrared intensities for the cis- and trans-HOCO and DOCO radicals. The Journal of Physical Chemistry. A. 117: 6932-9. PMID 23199284 DOI: 10.1021/Jp3102546 |
0.675 |
|
2012 |
Linguerri R, Francisco JS. Coupled-cluster and multireference configuration interaction study of the low-lying excited states of the H2O2-H2O complex. The Journal of Chemical Physics. 137: 214312. PMID 23231236 DOI: 10.1063/1.4769284 |
0.383 |
|
2012 |
Torrent-Sucarrat M, Francisco JS, Anglada JM. Sulfuric acid as autocatalyst in the formation of sulfuric acid. Journal of the American Chemical Society. 134: 20632-44. PMID 23198746 DOI: 10.1021/Ja307523B |
0.334 |
|
2012 |
Fortenberry RC, Huang X, Francisco JS, Crawford TD, Lee TJ. Fundamental vibrational frequencies and spectroscopic constants of HOCS+, HSCO+, and isotopologues via quartic force fields. The Journal of Physical Chemistry. A. 116: 9582-90. PMID 22950849 DOI: 10.1021/Jp3073206 |
0.694 |
|
2012 |
Hazra MK, Francisco JS, Sinha A. Computational study of hydrogen-bonded complexes of HOCO with acids: HOCO⋯HCOOH, HOCO⋯H2SO4, and HOCO⋯H2CO3. The Journal of Chemical Physics. 137: 064319. PMID 22897285 DOI: 10.1063/1.4742817 |
0.389 |
|
2012 |
Davis AC, Tangprasertchai N, Francisco JS. Hydrogen migrations in alkylcycloalkyl radicals: implications for chain-branching reactions in fuels. Chemistry (Weinheim An Der Bergstrasse, Germany). 18: 11296-305. PMID 22829453 DOI: 10.1002/Chem.201103517 |
0.588 |
|
2012 |
Fortenberry RC, Huang X, Francisco JS, Crawford TD, Lee TJ. Quartic force field predictions of the fundamental vibrational frequencies and spectroscopic constants of the cations HOCO+ and DOCO+. The Journal of Chemical Physics. 136: 234309. PMID 22779595 DOI: 10.1063/1.4729309 |
0.676 |
|
2012 |
Hochlaf M, Linguerri R, Dalal SS, Francisco JS. Theoretical study of the spectroscopically relevant parameters for the detection of HNP(q) and HPN(q) (q = 0, +1, -1) in the gas phase. The Journal of Chemical Physics. 136: 244311. PMID 22755578 DOI: 10.1063/1.4730299 |
0.374 |
|
2012 |
Ben Yaghlane S, Francisco JS, Hochlaf M. Accurate theoretical study of PS(q) (q = 0,+1,-1) in the gas phase. The Journal of Chemical Physics. 136: 244309. PMID 22755576 DOI: 10.1063/1.4730303 |
0.342 |
|
2012 |
Cotton CE, Francisco JS, Linguerri R, Mitrushchenkov AO. Structural and spectroscopic study of the van der Waals complex of CO with HCO+ and the isoelectronic complex of CS with HCS+. The Journal of Chemical Physics. 136: 184307. PMID 22583287 DOI: 10.1063/1.4707336 |
0.677 |
|
2012 |
Buszek RJ, Barker JR, Francisco JS. Water effect on the OH + HCl reaction. The Journal of Physical Chemistry. A. 116: 4712-9. PMID 22563978 DOI: 10.1021/Jp3025107 |
0.787 |
|
2012 |
Buszek RJ, Torrent-Sucarrat M, Anglada JM, Francisco JS. Effects of a single water molecule on the OH + H2O2 reaction. The Journal of Physical Chemistry. A. 116: 5821-9. PMID 22455374 DOI: 10.1021/Jp2077825 |
0.793 |
|
2012 |
Davis AC, Francisco JS. Ab initio study of chain branching reactions involving second generation products in hydrocarbon combustion mechanisms. Physical Chemistry Chemical Physics : Pccp. 14: 1343-51. PMID 22048707 DOI: 10.1039/C1Cp22602A |
0.6 |
|
2012 |
Kokkila SI, Bera PP, Francisco JS, Lee TJ. A group increment scheme for infrared absorption intensities of greenhouse gases Journal of Molecular Structure. 1009: 89-95. DOI: 10.1016/J.Molstruc.2011.11.048 |
0.416 |
|
2011 |
Clark J, Kumbhani S, Hansen JC, Francisco JS. HNO3-NHx, H2SO4-NHx, CH(O)OH-NHx, and CH3C(O)OH-NHx complexes and their role in the formation of condensation nuclei. The Journal of Chemical Physics. 135: 244305. PMID 22225154 DOI: 10.1063/1.3664302 |
0.652 |
|
2011 |
Fortenberry RC, Huang X, Francisco JS, Crawford TD, Lee TJ. Vibrational frequencies and spectroscopic constants from quartic force fields for cis-HOCO: the radical and the anion. The Journal of Chemical Physics. 135: 214303. PMID 22149788 DOI: 10.1063/1.3663615 |
0.684 |
|
2011 |
Fortenberry RC, Huang X, Francisco JS, Crawford TD, Lee TJ. The trans-HOCO radical: quartic force fields, vibrational frequencies, and spectroscopic constants. The Journal of Chemical Physics. 135: 134301. PMID 21992299 DOI: 10.1063/1.3643336 |
0.687 |
|
2011 |
Davis AC, Francisco JS. Reactivity trends within alkoxy radical reactions responsible for chain branching. Journal of the American Chemical Society. 133: 18208-19. PMID 21955032 DOI: 10.1021/Ja204806B |
0.629 |
|
2011 |
Davis AC, Francisco JS. Ab initio study of key branching reactions in biodiesel and Fischer-Tropsch fuels. Journal of the American Chemical Society. 133: 19110-24. PMID 21805995 DOI: 10.1021/Ja205516S |
0.632 |
|
2011 |
Du S, Germann TC, Francisco JS, Peterson KA, Yu HG, Lyons JR. The kinetics study of the S + S2 → S3 reaction by the chaperone mechanism. The Journal of Chemical Physics. 134: 154508. PMID 21513396 DOI: 10.1063/1.3572226 |
0.46 |
|
2011 |
Davis AC, Francisco JS. Ab initio study of hydrogen migration across n-alkyl radicals. The Journal of Physical Chemistry. A. 115: 2966-77. PMID 21413772 DOI: 10.1021/Jp110142H |
0.622 |
|
2011 |
Peterson KA, Francisco JS. Ab initio spectroscopic characterization of the HNNO and ONHN radicals. The Journal of Chemical Physics. 134: 084308. PMID 21361540 DOI: 10.1063/1.3556990 |
0.368 |
|
2011 |
Gonzalez J, Anglada JM, Buszek RJ, Francisco JS. Impact of water on the OH + HOCl reaction. Journal of the American Chemical Society. 133: 3345-53. PMID 21319861 DOI: 10.1021/Ja100976B |
0.794 |
|
2011 |
Buszek RJ, Sinha A, Francisco JS. The isomerization of methoxy radical: intramolecular hydrogen atom transfer mediated through acid catalysis. Journal of the American Chemical Society. 133: 2013-5. PMID 21275425 DOI: 10.1021/Ja1039874 |
0.792 |
|
2011 |
Wuebbles DJ, Patten KO, Wang D, Youn D, Martínez-Avilés M, Francisco JS. Three-dimensional model evaluation of the Ozone Depletion Potentials for n-propyl bromide, trichloroethylene and perchloroethylene Atmospheric Chemistry and Physics. 11: 2371-2380. DOI: 10.5194/Acp-11-2371-2011 |
0.765 |
|
2011 |
Buszek RJ, Francisco JS, Anglada JM. Water effects on atmospheric reactions International Reviews in Physical Chemistry. 30: 335-369. DOI: 10.1080/0144235X.2011.634128 |
0.759 |
|
2010 |
Francisco JS, Muckerman JT, Yu HG. HOCO radical chemistry. Accounts of Chemical Research. 43: 1519-26. PMID 20929216 DOI: 10.1021/ar100087v |
0.35 |
|
2010 |
Davis AC, Francisco JS. Ab initio study of hydrogen migration in 1-alkylperoxy radicals. The Journal of Physical Chemistry. A. 114: 11492-505. PMID 20883006 DOI: 10.1021/Jp1042393 |
0.641 |
|
2010 |
Christiansen CJ, Francisco JS. Atmospheric oxidation of trichloroethylene: an ab initio study. The Journal of Physical Chemistry. A. 114: 9163-76. PMID 20687539 DOI: 10.1021/Jp103769Z |
0.804 |
|
2010 |
Christiansen CJ, Francisco JS. Atmospheric oxidation of tetrachloroethylene: an ab initio study. The Journal of Physical Chemistry. A. 114: 9177-91. PMID 20669984 DOI: 10.1021/Jp103845H |
0.802 |
|
2010 |
Bera PP, Francisco JS, Lee TJ. Design strategies to minimize the radiative efficiency of global warming molecules. Proceedings of the National Academy of Sciences of the United States of America. 107: 9049-54. PMID 20439762 DOI: 10.1073/Pnas.0913590107 |
0.519 |
|
2010 |
Doan HQ, Davis AC, Francisco JS. Primary steps in the reaction of OH radicals with peptide systems: perspective from a study of model amides. The Journal of Physical Chemistry. A. 114: 5342-57. PMID 20369811 DOI: 10.1021/Jp100375C |
0.574 |
|
2010 |
Grant DJ, Garner EB, Matus MH, Nguyen MT, Peterson KA, Francisco JS, Dixon DA. Thermodynamic properties of the XO(2), X(2)O, XYO, X(2)O(2), and XYO(2) (X, Y = Cl, Br, and I) isomers. The Journal of Physical Chemistry. A. 114: 4254-65. PMID 20187618 DOI: 10.1021/Jp911320P |
0.395 |
|
2010 |
Christiansen CJ, Dalal SS, Francisco JS, Mebel AM, Gaffney JS. Hydroxyl radical substitution in halogenated carbonyls: oxalic acid formation. The Journal of Physical Chemistry. A. 114: 2806-20. PMID 20131850 DOI: 10.1021/Jp9045116 |
0.804 |
|
2010 |
Soloveichik P, O'Donnell BA, Lester MI, Francisco JS, McCoy AB. Infrared spectrum and stability of the H2O-HO complex: experiment and theory. The Journal of Physical Chemistry. A. 114: 1529-38. PMID 19831340 DOI: 10.1021/Jp907885D |
0.465 |
|
2010 |
Bera PP, Francisco JS, Lee TJ. Reply to Wallington et al.: Differences in electronic structure of global warming molecules lead to different molecular properties Proceedings of the National Academy of Sciences of the United States of America. 107: E180. DOI: 10.1073/Pnas.1008576107 |
0.439 |
|
2009 |
Yu HG, Francisco JS. Ab initio and RRKM study of the reaction of ClO with HOCO radicals. The Journal of Physical Chemistry. A. 113: 12932-41. PMID 19831339 DOI: 10.1021/Jp9040088 |
0.421 |
|
2009 |
Du S, Francisco JS, Schenter GK, Garrett BC. Interaction of ClO radical with liquid water. Journal of the American Chemical Society. 131: 14778-85. PMID 19788303 DOI: 10.1021/Ja9033186 |
0.538 |
|
2009 |
Grant DJ, Dixon DA, Francisco JS, Feller D, Peterson KA. Heats of formation of the H1,2OmSn (m, n = 0-3) molecules from electronic structure calculations. The Journal of Physical Chemistry. A. 113: 11343-53. PMID 19780577 DOI: 10.1021/Jp905847E |
0.427 |
|
2009 |
Bera PP, Francisco JS, Lee TJ. Identifying the molecular origin of global warming. The Journal of Physical Chemistry. A. 113: 12694-9. PMID 19694447 DOI: 10.1021/Jp905097G |
0.494 |
|
2009 |
Du S, Francisco JS. OH.N2 and SH.N2 radical-molecule van der Waals complex. The Journal of Chemical Physics. 131: 064307. PMID 19691388 DOI: 10.1063/1.3204980 |
0.583 |
|
2009 |
Liessmann M, Hansmann B, Blachly PG, Francisco JS, Abel B. Primary steps in the reaction of OH radicals with amino acids at low temperatures in Laval nozzle expansions: perspectives from experiment and theory. The Journal of Physical Chemistry. A. 113: 7570-5. PMID 19552478 DOI: 10.1021/Jp9015596 |
0.325 |
|
2009 |
Francisco JS, Eisfeld W. Atmospheric oxidation mechanism of hydroxymethyl hydroperoxide. The Journal of Physical Chemistry. A. 113: 7593-600. PMID 19453156 DOI: 10.1021/jp901735z |
0.326 |
|
2009 |
Buszek RJ, Francisco JS. The gas-phase decomposition of CF(3)OH with water: a radical-catalyzed mechanism. The Journal of Physical Chemistry. A. 113: 5333-7. PMID 19348491 DOI: 10.1021/Jp900642Q |
0.789 |
|
2009 |
Du S, Francisco JS, Kais S. Study of electronic structure and dynamics of interacting free radicals influenced by water. The Journal of Chemical Physics. 130: 124312. PMID 19334835 DOI: 10.1063/1.3100549 |
0.519 |
|
2009 |
Poggi G, Francisco JS. An ab initio study of the reaction of HOCO radicals with NO2: addition/elimination mechanism. The Journal of Chemical Physics. 130: 124306. PMID 19334829 DOI: 10.1063/1.3095757 |
0.434 |
|
2009 |
Du S, Francisco JS. Spectroscopic properties and stability of the SH x H2O open shell complex. The Journal of Chemical Physics. 130: 124304. PMID 19334827 DOI: 10.1063/1.3089869 |
0.551 |
|
2009 |
Christiansen CJ, Francisco JS. Atmospheric oxidation mechanism of 1,2-dibromoethane. The Journal of Physical Chemistry. A. 113: 7189-204. PMID 19117383 DOI: 10.1021/Jp807966P |
0.805 |
|
2008 |
Matthews J, Martínez-Avilés M, Francisco JS, Sinha A. Probing OH stretching overtones of CH3OOH through action spectroscopy: Influence of dipole moment dependence on HOOC torsion. The Journal of Chemical Physics. 129: 074316. PMID 19044776 DOI: 10.1063/1.2967185 |
0.795 |
|
2008 |
Matus MH, Nguyen MT, Dixon DA, Peterson KA, Francisco JS. ClClO2 is the most stable isomer of Cl2O2. Accurate coupled cluster energetics and electronic spectra of Cl2O2 isomers. The Journal of Physical Chemistry. A. 112: 9623-7. PMID 18778040 DOI: 10.1021/Jp806220R |
0.31 |
|
2008 |
Yu HG, Francisco JS, Muckerman JT. Ab initio and direct dynamics study of the reaction of Cl atoms with HOCO. The Journal of Chemical Physics. 129: 064301. PMID 18715063 DOI: 10.1063/1.2965523 |
0.327 |
|
2008 |
O'Donnell BA, Li EX, Lester MI, Francisco JS. Spectroscopic identification and stability of the intermediate in the OH + HONO2 reaction. Proceedings of the National Academy of Sciences of the United States of America. 105: 12678-83. PMID 18678905 DOI: 10.1073/Pnas.0800320105 |
0.372 |
|
2008 |
Martínez-Avilés M, Rosado-Reyes CM, Francisco JS. Hydroxyl-radical-initiated oxidation mechanism of bromopropane. The Journal of Physical Chemistry. A. 112: 7930-8. PMID 18666763 DOI: 10.1021/Jp8034506 |
0.806 |
|
2008 |
Ravelo RM, Francisco JS. Proton affinity of methyl nitrite and methyl peroxynitrite: implications for measuring branching ratios of alkyl nitrates and nitrites. Journal of the American Chemical Society. 130: 11234-9. PMID 18661999 DOI: 10.1021/Ja8045662 |
0.321 |
|
2008 |
Du S, Francisco JS, Shepler BC, Peterson KA. Determination of the rate constant for sulfur recombination by quasiclassical trajectory calculations. The Journal of Chemical Physics. 128: 204306. PMID 18513018 DOI: 10.1063/1.2919569 |
0.456 |
|
2008 |
Eisfeld W, Francisco JS. Excited states and photodissociation of hydroxymethyl hydroperoxide. The Journal of Chemical Physics. 128: 174304. PMID 18465919 DOI: 10.1063/1.2909547 |
0.369 |
|
2008 |
Du S, Francisco JS. Interaction between OH radical and the water interface. The Journal of Physical Chemistry. A. 112: 4826-35. PMID 18454512 DOI: 10.1021/Jp710509H |
0.495 |
|
2008 |
Grant DJ, Dixon DA, Kemeny AE, Francisco JS. Structures and heats of formation of the neutral and ionic PNO, NOP, and NPO systems from electronic structure calculations. The Journal of Chemical Physics. 128: 164305. PMID 18447437 DOI: 10.1063/1.2902983 |
0.428 |
|
2008 |
Grant DJ, Matus MH, Switzer JR, Dixon DA, Francisco JS, Christe KO. Bond dissociation energies in second-row compounds. The Journal of Physical Chemistry. A. 112: 3145-56. PMID 18351757 DOI: 10.1021/Jp710373E |
0.303 |
|
2008 |
Du S, Francisco JS, Schenter GK, Garrett BC. Many-body decomposition of the binding energies for OH.(H2O)2 and OH.(H2O)3 complexes. The Journal of Chemical Physics. 128: 084307. PMID 18315046 DOI: 10.1063/1.2828522 |
0.502 |
|
2008 |
Clark J, English AM, Hansen JC, Francisco JS. Computational study on the existence of organic peroxy radical-water complexes (RO2.H2O). The Journal of Physical Chemistry. A. 112: 1587-95. PMID 18225871 DOI: 10.1021/Jp077266D |
0.612 |
|
2008 |
Harkless JA, Francisco JS. Bond dissocation and conformational energetics of tetrasulfur: a quantum Monte Carlo study. The Journal of Physical Chemistry. A. 112: 2088-92. PMID 18217731 DOI: 10.1021/Jp076376H |
0.326 |
|
2008 |
Rosado-Reyes CM, Martínez-Avilés M, Francisco JS. Chapter 11 Computational Study of the Reaction of n-Bromopropane with OH Radicals and Cl Atoms Advances in Quantum Chemistry. 55: 215-244. DOI: 10.1016/S0065-3276(07)00211-0 |
0.81 |
|
2007 |
Matus MH, Dixon DA, Peterson KA, Harkless JA, Francisco JS. Coupled-cluster study of the electronic structure and energetics of tetrasulfur, S4. The Journal of Chemical Physics. 127: 174305. PMID 17994816 DOI: 10.1063/1.2774973 |
0.344 |
|
2007 |
Martínez-Avilés M, Rosado-Reyes CM, Francisco JS. Atmospheric oxidation mechanism of bromoethane. The Journal of Physical Chemistry. A. 111: 11652-60. PMID 17941615 DOI: 10.1021/Jp073862W |
0.808 |
|
2007 |
Yu HG, Muckerman JT, Francisco JS. Quantum force molecular dynamics study of the reaction of O atoms with HOCO. The Journal of Chemical Physics. 127: 094302. PMID 17824734 DOI: 10.1063/1.2770463 |
0.308 |
|
2007 |
Irikura KK, Francisco JS. Competition between hydrogen abstraction and halogen displacement in the reaction of Br with CH3I, CH3Br, and CH3Cl. The Journal of Physical Chemistry. A. 111: 6852-9. PMID 17580833 DOI: 10.1021/Jp071314C |
0.372 |
|
2007 |
Grant DJ, Dixon DA, Francisco JS. Coupled cluster study of the energetic properties of S2x (x=0,+1,1). The Journal of Chemical Physics. 126: 144308. PMID 17444713 DOI: 10.1063/1.2715580 |
0.334 |
|
2007 |
Du S, Francisco JS, Schenter GK, Garrett BC. Ab initio and analytical intermolecular potential for ClO-H2O. The Journal of Chemical Physics. 126: 114304. PMID 17381203 DOI: 10.1063/1.2566537 |
0.524 |
|
2007 |
Vöhringer-Martinez E, Hansmann B, Hernandez-Soto H, Hernandez H, Francisco JS, Troe J, Abel B. Water catalysis of a radical-molecule gas-phase reaction. Science (New York, N.Y.). 315: 497-501. PMID 17255507 DOI: 10.1126/Science.1134494 |
0.606 |
|
2007 |
Guha S, Francisco JS. An AB initio study of the structures, vibrational spectra, and energetics of AlSHX (X = -1, 0, +1) Astrophysical Journal. 671: 2159-2163. DOI: 10.1086/522883 |
0.605 |
|
2006 |
Greene JR, Francisco JS, Xu D, Huang J, Jackson WM. Photodissociation dynamics of CBr4 at 267 nm by means of ion velocity imaging. The Journal of Chemical Physics. 125: 133311. PMID 17029464 DOI: 10.1063/1.2213260 |
0.621 |
|
2006 |
Watts JD, Francisco JS. Ground and electronically excited states of methyl hydroperoxide: comparison with hydrogen peroxide. The Journal of Chemical Physics. 125: 104301. PMID 16999520 DOI: 10.1063/1.2338039 |
0.422 |
|
2006 |
Du S, Francisco JS, Schenter GK, Iordanov TD, Garrett BC, Dupuis M, Li J. The OH radical-H2O molecular interaction potential. The Journal of Chemical Physics. 124: 224318. PMID 16784285 DOI: 10.1063/1.2200701 |
0.566 |
|
2006 |
Christensen LE, Okumura M, Hansen JC, Sander SP, Francisco JS. Experimental and ab initio study of the HO2.CH3OH complex: thermodynamics and kinetics of formation. The Journal of Physical Chemistry. A. 110: 6948-59. PMID 16722709 DOI: 10.1021/Jp056579A |
0.62 |
|
2006 |
Francisco JS, Crowley JN. Theoretical investigation of product channels in the CH3O2 + Br reaction. The Journal of Physical Chemistry. A. 110: 3778-84. PMID 16526662 DOI: 10.1021/jp056794r |
0.318 |
|
2005 |
Schnell M, Francisco JS, Peyerimhoff SD. MRD-CI study of the photodissociative behavior of HOOOCl, a molecule relevant to atmospheric chemistry. Physical Chemistry Chemical Physics : Pccp. 7: 1912-7. PMID 19787892 DOI: 10.1039/B501433F |
0.311 |
|
2005 |
von Ahsen S, Francisco JS. Spectroscopic evidence for the existence of the CF3OSO3 radical. The Journal of Physical Chemistry. A. 109: 9193-5. PMID 16833257 DOI: 10.1021/Jp054956D |
0.391 |
|
2005 |
Rosado-Reyes CM, Francisco JS, Szente JJ, Maricq MM, Frøsig Østergaard L. Dimethyl ether oxidation at elevated temperatures (295-600 K). The Journal of Physical Chemistry. A. 109: 10940-53. PMID 16331938 DOI: 10.1021/Jp054223T |
0.409 |
|
2005 |
Goebbert DJ, Hernandez H, Francisco JS, Wenthold PG. The binding energy and bonding in dialane. Journal of the American Chemical Society. 127: 11684-9. PMID 16104745 DOI: 10.1021/Ja0424070 |
0.578 |
|
2005 |
Matthews J, Sinha A, Francisco JS. Unimolecular dissociation and thermochemistry of CH3OOH. The Journal of Chemical Physics. 122: 221101. PMID 15974643 DOI: 10.1063/1.1928228 |
0.377 |
|
2005 |
Matthews J, Sinha A, Francisco JS. The importance of weak absorption features in promoting tropospheric radical production. Proceedings of the National Academy of Sciences of the United States of America. 102: 7449-52. PMID 15890778 DOI: 10.1073/Pnas.0502687102 |
0.349 |
|
2005 |
Whitney ES, Zolot AM, McCoy AB, Francisco JS, Nesbitt DJ. Reactive scattering dynamics in atom+polyatomic systems: F+C2H6-->HF(v,J)+C2H5. The Journal of Chemical Physics. 122: 124310. PMID 15836381 DOI: 10.1063/1.1868553 |
0.35 |
|
2005 |
McCoy AB, Fry JL, Francisco JS, Mollner AK, Okumura M. Role of OH-stretch/torsion coupling and quantum yield effects in the first OH overtone spectrum of cis-cis HOONO. The Journal of Chemical Physics. 122: 104311. PMID 15836319 DOI: 10.1063/1.1859273 |
0.375 |
|
2005 |
Suitte BP, Belair SD, Francisco JS. Spectroscopic characterization of the five possible orientations of a hydrogen-bonded pair of water molecules within the cubic water octamer framework Physical Review a - Atomic, Molecular, and Optical Physics. 71. DOI: 10.1103/Physreva.71.043204 |
0.371 |
|
2005 |
Belair SD, Francisco JS, Singer SJ. Hydrogen bonding in cubic (H 2O) 8 and OH·(H 2O) 7 clusters Physical Review a - Atomic, Molecular, and Optical Physics. 71. DOI: 10.1103/Physreva.71.013204 |
0.317 |
|
2004 |
García P, Willner H, Oberhammer H, Francisco JS. The matrix-isolated molecular complexes CO/XF (X=Cl,Br,I) and the molecular structure of FC(O)Br. The Journal of Chemical Physics. 121: 11900-6. PMID 15634151 DOI: 10.1063/1.1814634 |
0.38 |
|
2004 |
Santiano RL, Francisco JS. Protonation study of peroxynitric acid and peroxynitrous acid. The Journal of Chemical Physics. 121: 9498-509. PMID 15538871 DOI: 10.1063/1.1784779 |
0.346 |
|
2004 |
Pernice H, Garcia P, Willner H, Francisco JS, Mills FP, Allen M, Yung YL. Laboratory evidence for a key intermediate in the Venus atmosphere: peroxychloroformyl radical. Proceedings of the National Academy of Sciences of the United States of America. 101: 14007-10. PMID 15375212 DOI: 10.1073/Pnas.0405501101 |
0.36 |
|
2004 |
Greene JR, Francisco JS, Huang J, Xu D, Jackson WM. Photodissociation studies of CBr(4) (+) and CBr(3) (+) at 267 nm using ion velocity imaging. The Journal of Chemical Physics. 121: 5868-73. PMID 15367014 DOI: 10.1063/1.1786926 |
0.588 |
|
2004 |
Matthews J, Sinha A, Francisco JS. High level ab initio study of the structure and vibrational spectra of HO(2)NO(2). The Journal of Chemical Physics. 121: 5720-7. PMID 15366995 DOI: 10.1063/1.1783131 |
0.385 |
|
2004 |
Peterson KA, Francisco JS. Does chlorine peroxide absorb below 250 nm? The Journal of Chemical Physics. 121: 2611-6. PMID 15281859 DOI: 10.1063/1.1766012 |
0.329 |
|
2004 |
Matthews J, Sinha A, Francisco JS. Relative vibrational overtone intensity of cis-cis and trans-perp peroxynitrous acid. The Journal of Chemical Physics. 120: 10543-53. PMID 15268081 DOI: 10.1063/1.1738105 |
0.342 |
|
2004 |
Poggi G, Francisco JS. An ab initio study of the competing reaction channels in the reaction of HOCO radicals with NO and O2. The Journal of Chemical Physics. 120: 5073-80. PMID 15267375 DOI: 10.1063/1.1646353 |
0.404 |
|
2004 |
von Ahsen S, Willner H, Francisco JS. Thermal decomposition of peroxy acetyl nitrate CH3C(O)OONO2. The Journal of Chemical Physics. 121: 2048-57. PMID 15260758 DOI: 10.1063/1.1767813 |
0.411 |
|
2004 |
Fry JL, Nizkorodov SA, Okumura M, Roehl CM, Francisco JS, Wennberg PO. Cis-cis and trans-perp HOONO: action spectroscopy and isomerization kinetics. The Journal of Chemical Physics. 121: 1432-48. PMID 15260688 DOI: 10.1063/1.1760714 |
0.34 |
|
2004 |
Belair SD, Hernandez H, Francisco JS. The origin of sticking between a hydroperoxy radical and a water surface. Journal of the American Chemical Society. 126: 3024-5. PMID 15012112 DOI: 10.1021/Ja030604D |
0.639 |
|
2004 |
Enami S, Nakano Y, Hashimoto S, Kawasaki M, Aloisio S, Francisco JS. Reactions of Cl atoms with dimethyl Sulfide: A theoretical calculation and an experimental study with cavity ring-down spectroscopy Journal of Physical Chemistry A. 108: 7785-7789. DOI: 10.1021/Jp049772Y |
0.728 |
|
2004 |
McGivern WS, Kim H, Francisco JS, North SW. Investigation of the atmospheric oxidation pathways of bromoform and dibromomethane: Initiation via UV photolysis and hydrogen abstraction Journal of Physical Chemistry A. 108: 7247-7252. DOI: 10.1021/Jp0311613 |
0.466 |
|
2003 |
Parthiban S, Lee TJ, Guha S, Francisco JS. Theoretical study of chlorine nitrates: implications for stratospheric chlorine chemistry. Journal of the American Chemical Society. 125: 10446-58. PMID 12926970 DOI: 10.1021/Ja010297G |
0.674 |
|
2003 |
Shi Q, Belair SD, Francisco JS, Kais S. On the interactions between atmospheric radicals and cloud droplets: a molecular picture of the interface. Proceedings of the National Academy of Sciences of the United States of America. 100: 9686-90. PMID 12904576 DOI: 10.1073/Pnas.1733696100 |
0.306 |
|
2003 |
Belair SD, Francisco JS. Stability of the cubic water octamer Physical Review A. 67: 63206. DOI: 10.1103/Physreva.67.063206 |
0.308 |
|
2003 |
Peterson KA, Li Y, Francisco JS, Zou P, Webster CE, Pérez LM, Hall MB, North SW. The role of triplet states in the long wavelength absorption region of bromine nitrate Journal of Chemical Physics. 119: 7864-7870. DOI: 10.1063/1.1604374 |
0.303 |
|
2003 |
Kemeny AE, Francisco JS, Dixon DA, Feller D. Accurateab initiostudy of the energetics of phosphorus nitride: Heat of formation, ionization potential, and electron affinity The Journal of Chemical Physics. 118: 8290-8295. DOI: 10.1063/1.1565317 |
0.314 |
|
2003 |
Watts JD, Francisco JS. Molecular structure, vibrational frequencies, energetics, and excited states of the HOONO+ ions Journal of Chemical Physics. 118: 1721-1728. DOI: 10.1063/1.1531661 |
0.407 |
|
2003 |
Guha S, Francisco JS. An ab initio study of the pathways for the reaction between CH3O2 and BrO radicals Journal of Chemical Physics. 118: 1779-1793. DOI: 10.1063/1.1531099 |
0.628 |
|
2003 |
Bean BD, Mollner AK, Nizkorodov SA, Nair G, Okumura M, Sander SP, Peterson KA, Francisco JS. Cavity Ringdown Spectroscopy of cis-cis HOONO and the HOONO/HONO 2 Branching Ratio in the Reaction OH + NO2 + M Journal of Physical Chemistry A. 107: 6974-6985. DOI: 10.1021/Jp034407C |
0.316 |
|
2003 |
Aloisio S, Francisco JS. Complexes of hydroperoxyl radical with glyoxal, methylglyoxal, methylvinyl ketone, acrolein, and methacrolein: Possible new sinks for HO2 in the atmosphere? Journal of Physical Chemistry A. 107: 2492-2496. DOI: 10.1021/Jp022636D |
0.729 |
|
2003 |
Dixon DA, Feller D, Francisco JS. Molecular structure, vibrational frequencies, and energetics of the HCO, HOCO, and HCO2 anions Journal of Physical Chemistry A. 107: 186-190. DOI: 10.1021/Jp0220736 |
0.355 |
|
2003 |
Aaltonen ET, Francisco JS. HOSO2−H2O Radical Complex and Its Possible Effects on the Production of Sulfuric Acid in the Atmosphere Journal of Physical Chemistry A. 107: 1216-1221. DOI: 10.1021/Jp021977O |
0.384 |
|
2003 |
Feller D, Dixon DA, Francisco JS. Coupled Cluster Theory Determination of the Heats of Formation of Combustion-Related Compounds: CO, HCO, CO2, HCO2, HOCO, HC(O)OH, and HC(O)OOH The Journal of Physical Chemistry A. 107: 1604-1617. DOI: 10.1021/Jp021569K |
0.32 |
|
2003 |
Hansen JC, Li Y, Rosado-Reyes CM, Francisco JS, Szente JJ, Maricq MM. Theoretical and experimental investigation of the UV cross section and kinetics of the methyl formate peroxy radical Journal of Physical Chemistry A. 107: 5306-5316. DOI: 10.1021/Jp021180X |
0.643 |
|
2002 |
Hansen JC, Francisco JS. Radical-molecule complexes: changing our perspective on the molecular mechanisms of radical-molecule reactions and their impact on atmospheric chemistry. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 3: 833-40. PMID 12465180 DOI: 10.1002/1439-7641(20021018)3:10<833::Aid-Cphc833>3.0.Co;2-0 |
0.6 |
|
2002 |
Odeh IN, Francisco JS, Margerum DW. New pathways for chlorine dioxide decomposition in basic solution Inorganic Chemistry. 41: 6500-6506. PMID 12444796 DOI: 10.1021/Ic0204676 |
0.354 |
|
2002 |
Eisfeld W, Francisco JS. Are helionitronium trications stable Proceedings of the National Academy of Sciences of the United States of America. 99: 15303-15307. PMID 12429854 DOI: 10.1073/Pnas.242490299 |
0.351 |
|
2002 |
Xu D, Huang J, Francisco JS, Hansen JC, Jackson WM. Photodissociation of carbonic dibromide at 267 nm: Observation of three-body dissociation and molecular elimination of Br2 Journal of Chemical Physics. 117: 7483-7490. DOI: 10.1063/1.1509063 |
0.602 |
|
2002 |
Clements TG, Continetti RE, Francisco JS. Exploring the OH+CO→H+CO2 potential surface via dissociative photodetachment of (HOCO)- Journal of Chemical Physics. 117: 6478-6488. DOI: 10.1063/1.1505439 |
0.408 |
|
2002 |
Francisco JS. Coupled cluster study of the energetic and spectroscopic properties of OPOx (x=O,+1,−1) Journal of Chemical Physics. 117: 3190-3195. DOI: 10.1063/1.1494063 |
0.351 |
|
2002 |
Xu D, Francisco JS, Huang J, Jackson WM. Ultraviolet photodissociation of bromoform at 234 and 267 nm by means of ion velocity imaging Journal of Chemical Physics. 117: 2578. DOI: 10.1063/1.1491877 |
0.322 |
|
2002 |
McGivern WS, Francisco JS, North SW. Investigation of the atmospheric oxidation pathways of bromoform: Initiation via OH/Cl reactions Journal of Physical Chemistry A. 106: 6395-6400. DOI: 10.1021/Jp0255886 |
0.427 |
|
2002 |
Dixon DA, Jong WAD, Peterson KA, Francisco JS. Heats of Formation of CBr, CHBr, and CBr2 from Ab Initio Quantum Chemistry Journal of Physical Chemistry A. 106: 4725-4728. DOI: 10.1021/Jp0147067 |
0.324 |
|
2002 |
Chen Y, Zhu L, Francisco JS. Wavelength-Dependent Photolysis ofn-Butyraldehyde andi-Butyraldehyde in the 280−330-nm Region Journal of Physical Chemistry A. 106: 7755-7763. DOI: 10.1021/Jp014544E |
0.328 |
|
2002 |
Staikova M, Donaldson DJ, Francisco JS. Overtone-Induced Reactions on the HO2NO2 Potential Surface Journal of Physical Chemistry A. 106: 3023-3028. DOI: 10.1021/Jp0143746 |
0.448 |
|
2002 |
Dixon DA, Feller D, Zhan C, Francisco JS. Decomposition Pathways of Peroxynitrous Acid: Gas-Phase and Solution Energetics The Journal of Physical Chemistry A. 106: 3191-3196. DOI: 10.1021/Jp013783Z |
0.44 |
|
2002 |
Good DA, Francisco JS. A computational study of the reaction of methyl formate with ·H and ·CH3 radicals Journal of Physical Chemistry A. 106: 1733-1738. DOI: 10.1021/Jp012905K |
0.39 |
|
2002 |
Peterson SD, Francisco JS. Theoretical study of the thermal decomposition pathways of 2-H heptafluoropropane Journal of Physical Chemistry A. 106: 3106-3113. DOI: 10.1021/Jp012763U |
0.392 |
|
2001 |
Miller CE, Francisco JS. The formation of a surprisingly stable HO2-H2SO4 complex [1] Journal of the American Chemical Society. 123: 10387-10388. PMID 11603990 DOI: 10.1021/Ja016268N |
0.314 |
|
2001 |
Liu Q, Schurter LM, Muller CE, Aloisio S, Francisco JS, Margerum DW. Kinetics and mechanisms of aqueous ozone reactions with bromide, sulfite, hydrogen sulfite, iodide, and nitrite ions Inorganic Chemistry. 40: 4436-4442. PMID 11487352 DOI: 10.1021/Ic000919J |
0.718 |
|
2001 |
Li Y, Francisco JS. Complete active space self-consistent field and multireference configuration interaction studies of the low-lying excited states of the ClO–H2O radical complex Journal of Chemical Physics. 115: 8381-8383. DOI: 10.1063/1.1412001 |
0.321 |
|
2001 |
Peterson KA, Flowers BA, Francisco JS. Accurate ab initio spectroscopic and thermodynamic properties of BBrx and HBBrx (x=0, +1, -1) Journal of Chemical Physics. 115: 7513-7521. DOI: 10.1063/1.1405435 |
0.356 |
|
2001 |
Francisco JS. Deprotonation energy of HO2: Basis set limit energies Journal of Chemical Physics. 115: 6373-6375. DOI: 10.1063/1.1402169 |
0.345 |
|
2001 |
Francisco JS. Protonated nitrous acid (H2ONO+): Molecular structure, vibrational frequencies, and proton affinity Journal of Chemical Physics. 115: 2117-2122. DOI: 10.1063/1.1383987 |
0.387 |
|
2001 |
Li Y, Francisco JS. CASSCF and MRCI studies of the electronic excited states of CH2Cl and CH2Br Journal of Chemical Physics. 114: 2879-2882. DOI: 10.1063/1.1346577 |
0.336 |
|
2001 |
Li Y, Francisco JS. A complete active space self-consistent field multiconfiguration reference configuration interaction study of the potential energy curves of the ground and excited states of CCl Journal of Chemical Physics. 114: 2192-2196. DOI: 10.1063/1.1336542 |
0.346 |
|
2001 |
Li Y, Francisco JS. Low-lying excited states of HO2–HONO, HO2–HONO2, and HO2–HO2NO2 complexes Journal of Chemical Physics. 114: 211-214. DOI: 10.1063/1.1328749 |
0.345 |
|
2001 |
and SG, Francisco JS. An Investigation of the Structures, Vibrational Spectra, and Relative Energetics of CH3COBrO3 Isomers Journal of Physical Chemistry A. 105: 4495-4503. DOI: 10.1021/Jp0038409 |
0.422 |
|
2001 |
Flowers BA, Francisco JS. Ab Initio Characterization of the Structure, Vibrational, and Energetic Properties of Br-·HOCl, Cl-·HOBr, and Br-·HOBr Anionic Complexes Journal of Physical Chemistry A. 105: 494-500. DOI: 10.1021/Jp003229+ |
0.383 |
|
2001 |
Miller CE, Francisco JS. Proton Affinity of Peroxyacetyl Nitrate (PAN) Journal of Physical Chemistry A. 105: 750-754. DOI: 10.1021/Jp0030185 |
0.394 |
|
2001 |
Miller CE, Francisco JS. Symmetry Breaking and the Molecular Structure of NO3 Journal of Physical Chemistry A. 105: 1662-1668. DOI: 10.1021/Jp002349E |
0.369 |
|
2001 |
Roehl CM, Mazely TL, Friedl RR, Li Y, Francisco JS, Sander SP. NO2 quantum yield from the 248 nm photodissociation of peroxynitric acid (HO2NO2) Journal of Physical Chemistry A. 105: 1592-1598. DOI: 10.1021/Jp001982X |
0.347 |
|
2000 |
Aloisio S, Francisco JS. Radical-water complexes in Earth's atmosphere. Accounts of Chemical Research. 33: 825-30. PMID 11123881 DOI: 10.1021/ar000097u |
0.695 |
|
2000 |
Li Y, Francisco JS. CASSCF and MRCI studies on the electronic excited states of CHBrO, CClBrO, and CBr2O Journal of Chemical Physics. 113: 1807-1812. DOI: 10.1063/1.481984 |
0.367 |
|
2000 |
Li Y, Francisco JS. Ab initio studies on the low-lying excited states of ClO3 and BrO3 Journal of Chemical Physics. 112: 8866-8870. DOI: 10.1063/1.481501 |
0.346 |
|
2000 |
Peterson KA, Francisco JS. Low-lying excited states of HOOOCl and HOOOBr The Journal of Chemical Physics. 112: 8483-8486. DOI: 10.1063/1.481450 |
0.33 |
|
2000 |
Li Y, Francisco JS, Peterson KA. A complete active space self-consistent field multireference configuration interaction study of the low-lying excited states of BrO The Journal of Chemical Physics. 113: 8556-8560. DOI: 10.1063/1.1318751 |
0.349 |
|
2000 |
Hansen JC, Li Y, Francisco JS, Szente JJ, Maricq MM. Experimental and computational study of the methyl formate radical ultraviolet spectrum Journal of Chemical Physics. 113: 6465-6468. DOI: 10.1063/1.1318741 |
0.571 |
|
2000 |
Li Y, Francisco JS. High level ab initio studies on the excited states of HOCO radical Journal of Chemical Physics. 113: 7963-7970. DOI: 10.1063/1.1316011 |
0.349 |
|
2000 |
Li Y, Francisco JS. High level ab initio molecular orbital theory study of the structure, vibrational spectrum, stability, and low-lying excited states of HOONO Journal of Chemical Physics. 113: 7976-7981. DOI: 10.1063/1.1316010 |
0.363 |
|
2000 |
Michalowski BA, Francisco JS, Li S, Barrie LA, Bottenheim JW, Shepson PB. A computer model study of multiphase chemistry in the Arctic boundary layer during polar sunrise Journal of Geophysical Research. 105: 15131-15145. DOI: 10.1029/2000Jd900004 |
0.319 |
|
2000 |
Aloisio S, Francisco JS. Complexes of Hydroxyl and Hydroperoxyl Radical with Formaldehyde, Acetaldehyde, and Acetone Journal of Physical Chemistry A. 104: 3211-3224. DOI: 10.1021/Jp993789C |
0.727 |
|
2000 |
McGivern WS, Derecskei-Kovacs aA, North SW, Francisco JS. Computationally Efficient Methodology to Calculate C−H and C−X (X = F, Cl, and Br) Bond Dissociation Energies in Haloalkanes Journal of Physical Chemistry A. 104: 7916-7916. DOI: 10.1021/Jp993275D |
0.37 |
|
2000 |
Aloisio S, Francisco JS. A Density Functional Study of the H2O−HOCO Complex Journal of Physical Chemistry A. 104: 404-407. DOI: 10.1021/Jp9928356 |
0.73 |
|
2000 |
Nickolaisen SL, Roehl CM, Blakeley LK, Friedl RR, Francisco JS, Liu R, Sander SP. Temperature Dependence of the HO(sub 2) + CIO Reaction. 1. Reaction Kinetics by Pulsed Photolysis-Ultraviolet Absorption and ab initio Studies of the Potential Surface Journal of Physical Chemistry A. 104: 308-319. DOI: 10.1021/Jp992753H |
0.408 |
|
2000 |
Good DA, Hansen J, Kamoboures M, Santiono aR, Francisco JS. An Experimental and Computational Study of the Kinetics and Mechanism of the Reaction of Methyl Formate with Cl Atoms Journal of Physical Chemistry A. 104: 1505-1511. DOI: 10.1021/Jp992478Z |
0.64 |
|
2000 |
Francisco JS. Coupled Cluster and Second-Order Møller−Plesset Perturbation Studies of the Mechanism of the Gas-Phase Atom−Radical Reaction of Atomic Hydrogen with CF2 Radical Journal of Physical Chemistry A. 104: 1499-1504. DOI: 10.1021/Jp992319F |
0.368 |
|
2000 |
Good DA, Francisco JS. Tropospheric Oxidation Mechanism of Dimethyl Ether and Methyl Formate Journal of Physical Chemistry A. 104: 1171-1185. DOI: 10.1021/Jp9919718 |
0.364 |
|
2000 |
Pradeep T, Ma S, Shen J, Francisco JS, Cooks RG. Activation of Dioxygen by Halocarbon Ions The Journal of Physical Chemistry A. 104: 6804-6808. DOI: 10.1021/Jp001682F |
0.465 |
|
2000 |
Guha S, Francisco JS. A Theoretical Examination of the Isomerization Pathways for HBrO3Isomers Journal of Physical Chemistry A. 104: 9321-9327. DOI: 10.1021/Jp001604S |
0.656 |
|
2000 |
Aloisio S, Francisco JS. Reaction rate constant determination of association reactions using theoretical calculations: a case study of the HO2 + NO2 reaction Journal of Physical Chemistry A. 104: 6212-6217. DOI: 10.1021/Jp000736I |
0.742 |
|
2000 |
and SA, Francisco JS, Friedl RR. Experimental Evidence for the Existence of the HO2−H2O Complex Journal of Physical Chemistry A. 104: 6597-6601. DOI: 10.1021/Jp0006330 |
0.367 |
|
2000 |
Dixon DA, Peterson KA, Francisco JS. Molecular structures and energetics of Cl2CO, ClCO, Br2CO, and BrCO Journal of Physical Chemistry A. 104: 6227-6232. DOI: 10.1021/Jp0005571 |
0.378 |
|
2000 |
Aloisio S, Francisco JS. New radical - Molecule association compounds Journal of the American Chemical Society. 122: 9196-9200. DOI: 10.1021/Ja000891A |
0.695 |
|
1999 |
Li Y, Francisco JS. A CASSCF–MRCI study on the low-lying excited states of CH3OCl Journal of Chemical Physics. 111: 8384-8388. DOI: 10.1063/1.480180 |
0.344 |
|
1999 |
Li Z, Francisco JS. A coupled-cluster study of the HOBr→HBrO transition state Journal of Chemical Physics. 111: 5780-5782. DOI: 10.1063/1.479875 |
0.329 |
|
1999 |
Francisco JS. A coupled-cluster study of the mechanism for the CHF+H reaction The Journal of Chemical Physics. 111: 3457-3463. DOI: 10.1063/1.479672 |
0.382 |
|
1999 |
Flowers BA, Francisco JS. A coupled-cluster study of the molecular structure, vibrational frequencies, and energetics of COBr+ and BrCO+ cations Journal of Chemical Physics. 111: 3464-3467. DOI: 10.1063/1.479631 |
0.336 |
|
1999 |
Aloisio S, Li Y, Francisco JS. Complete active space self-consistent field and multireference configuration interaction studies of the differences between the low-lying excited states of HO2 and HO2–H2O Journal of Chemical Physics. 110: 9017-9019. DOI: 10.1063/1.478821 |
0.704 |
|
1999 |
Liu R, Maricq MM, Li Y, Francisco JS. Ab initio study of the electronic spectrum of the CH3OCH2 radical Journal of Chemical Physics. 110: 4410-4412. DOI: 10.1063/1.478323 |
0.35 |
|
1999 |
Li Y, Francisco JS. A CASSCF-MRCI study of the electronic excited states of FClO and FOCl Journal of Chemical Physics. 110: 2404-2409. DOI: 10.1063/1.477945 |
0.33 |
|
1999 |
Miller CE, Lynton aJI, Keevil DM, Francisco JS. Dissociation Pathways of Peroxyacetyl Nitrate (PAN) Journal of Physical Chemistry A. 103: 11451-11459. DOI: 10.1021/Jp992667H |
0.378 |
|
1999 |
Good DA, Kamboures M, Santiano R, Francisco JS. Atmospheric Oxidation of Fluorinated Ethers, E143a (CF3OCH3), E134 (CHF2OCHF2), and E125 (CHF2OCF3) Journal of Physical Chemistry A. 103: 9230-9240. DOI: 10.1021/Jp991979H |
0.365 |
|
1999 |
Guha S, Francisco JS. An Examination Of The Reaction Pathways For The Hooobr And Hoobro Complexes Formed From The Ho2 + Bro Reaction Journal of Physical Chemistry A. 103: 8000-8007. DOI: 10.1021/Jp9918961 |
0.629 |
|
1999 |
Hansen JC, Li Y, Francisco JS, Li Z. On The Mechanism Of The Bro + Ch2O Reaction Journal of Physical Chemistry A. 103: 8543-8546. DOI: 10.1021/Jp991757J |
0.644 |
|
1999 |
Aloisio S, Francisco JS. Structure and Energetics of Hydrogen Bonded HOx−HNO3 Complexes Journal of Physical Chemistry A. 103: 6049-6053. DOI: 10.1021/Jp9910789 |
0.739 |
|
1999 |
Peterson S, Good DA, Francisco JS. A Density Functional Study of the Structures and Energetics of CXBrO where X = H, Cl, and Br Journal of Physical Chemistry A. 103: 916-920. DOI: 10.1021/Jp983715L |
0.346 |
|
1999 |
Crawford MA, Wallington TJ, Szente JJ, Maricq MM, Francisco JS. Kinetics And Mechanism Of The Acetylperoxy + Ho2 Reaction Journal of Physical Chemistry A. 103: 365-378. DOI: 10.1021/Jp983150T |
0.4 |
|
1999 |
Aloisio S, Francisco JS. Water complexation as a means of stabilizing the metastable HO3 radical Journal of the American Chemical Society. 121: 8592-8596. DOI: 10.1021/Ja991001Y |
0.727 |
|
1999 |
Richardson SL, Francisco JS, Mebel A, Morokuma K. Can chlorine anion catalyze the reaction of HOC1 with HCI Computer Physics Communications. 724. DOI: 10.1016/S0010-4655(06)70127-8 |
0.337 |
|
1998 |
Li Z, Francisco JS. High level ab initio molecular orbital study of the structures and vibrational spectra of CHBr+ and CBr+ Journal of Chemical Physics. 110: 817-822. DOI: 10.1063/1.478049 |
0.38 |
|
1998 |
Francisco JS, Parthiban S, Lee TJ. Adiabatic electron affinity and ionization potential for BrO radical Journal of Chemical Physics. 109: 10818-10822. DOI: 10.1063/1.477778 |
0.509 |
|
1998 |
Francisco JS. Post-Hartree-Fock study on FOCl + and FClO + Journal of Chemical Physics. 108: 659-663. DOI: 10.1063/1.475427 |
0.345 |
|
1998 |
and SG, Francisco JS. Structures, Vibrational Spectra, and Relative Energetics of CH3BrO3 Isomers Journal of Physical Chemistry A. 102: 2072-2079. DOI: 10.1021/Jp993964P |
0.427 |
|
1998 |
Guha S, Francisco JS. Density-Functional Study Of The Equilibrium Structures, Vibrational Spectra, And Energetics Of Ch3Obr And Ch3Bro Journal of Physical Chemistry A. 102: 9970-9974. DOI: 10.1021/Jp983216K |
0.583 |
|
1998 |
O'Brien JM, Czuba E, Hastie DR, Francisco JS, Shepson PB. Determination of the Hydroxy Nitrate Yields from the Reaction of C2−C6 Alkenes with OH in the Presence of NO Journal of Physical Chemistry A. 102: 8903-8908. DOI: 10.1021/Jp982320Z |
0.365 |
|
1998 |
Guha S, Francisco JS. A Density Functional Study Of The Equilibrium Structure, Vibrational Spectrum, And Heat Of Formation Of Br2O3 Journal of Physical Chemistry A. 102: 6702-6705. DOI: 10.1021/Jp9819184 |
0.559 |
|
1998 |
Liu R, Francisco JS. Ab Initio Study Of The Mechanism For The Reaction Of Cf2 Radicals With Oh Journal of Physical Chemistry A. 102: 9869-9875. DOI: 10.1021/Jp981804S |
0.409 |
|
1998 |
Francisco JS, Clark J. Study Of The Stability Of Brclo3 Isomers Journal of Physical Chemistry A. 102: 2209-2214. DOI: 10.1021/Jp972853S |
0.365 |
|
1998 |
Nash JJ, Francisco JS. Unimolecular Decomposition Pathways of Dimethyl Ether: An ab Initio Study Journal of Physical Chemistry A. 102: 236-241. DOI: 10.1021/Jp9722566 |
0.373 |
|
1998 |
Nicoll G, Francisco JS. Carbon Atom-Initiated Degradation of Carbon Tetrachloride in the Presence of Molecular Oxygen: A Product and Mechanistic Study Environmental Science & Technology. 32: 3200-3206. DOI: 10.1021/Es980475E |
0.751 |
|
1997 |
Francisco JS, Liu R. An ab initio study of OCCN and OCCN Journal of Chemical Physics. 107: 3840-3844. DOI: 10.1063/1.474743 |
0.375 |
|
1997 |
Miller CE, Nickolaisen SL, Francisco JS, Sander SP. The OBrO C(2A2)←X(2B1) absorption spectrum Journal of Chemical Physics. 107: 2300-2307. DOI: 10.1063/1.474606 |
0.337 |
|
1997 |
Clark J, Francisco JS. Study Of The Stability Of Cl2O3 Using Ab Initio Methods Journal of Physical Chemistry A. 101: 7145-7153. DOI: 10.1021/Jp971465N |
0.381 |
|
1997 |
Crawford MA, Szente JJ, Maricq MM, Francisco JS. Kinetics of the Reaction between Cyclopentylperoxy Radicals and HO2 Journal of Physical Chemistry A. 101: 5337-5343. DOI: 10.1021/Jp9710704 |
0.381 |
|
1997 |
Guha S, Francisco JS. A Density Functional Study Of The Structure, Vibrational Spectra, And Relative Energetics Of Xbro2 Isomers (Where X = H, Cl, And Br) Journal of Physical Chemistry A. 101: 5347-5359. DOI: 10.1021/Jp970166V |
0.571 |
|
1997 |
Horwitz RJ, Francisco JS, Guest JA. Photofragmentation of Acetyl Cyanide at 193 nm Journal of Physical Chemistry A. 101: 1231-1237. DOI: 10.1021/Jp963800Y |
0.361 |
|
1997 |
Dibble TS, Francisco JS. Structure, vibrational frequencies, and stability of a reactive intermediate: FOONO Journal of the American Chemical Society. 119: 2894-2895. DOI: 10.1021/Ja952332N |
0.372 |
|
1995 |
Schneider WF, Maricq MM, Francisco JS. The vibrational spectrum of FC(O)O radical: A challenging case for single-reference electron correlation methods Journal of Chemical Physics. 103: 6601-6607. DOI: 10.1063/1.470389 |
0.377 |
|
1995 |
Francisco JS, Richardson SL. Determination of the CC bond dissociation energy in cyanogen Journal of Chemical Physics. 102: 1100-1101. DOI: 10.1063/1.469460 |
0.332 |
|
1995 |
Dibble TS, Maricq MM, Szente JJ, Francisco JS. Kinetics Of The Reaction Of Cf3O With No The Journal of Physical Chemistry. 99: 17394-17402. DOI: 10.1021/J100048A014 |
0.305 |
|
1995 |
Maricq MM, Szente JJ, Khitrov GA, Dibble TS, Francisco JS. CF3CO dissociation kinetics The Journal of Physical Chemistry. 99: 11875-11882. DOI: 10.1021/J100031A014 |
0.313 |
|
1995 |
Dibble TS, Francisco JS. Ab Initio Study of the Structure, Binding Energy, and Vibrations of the HOCl-H2O Complex The Journal of Physical Chemistry. 99: 1919-1922. DOI: 10.1021/J100007A021 |
0.363 |
|
1994 |
Francisco JS, Richardson SL. Determination of the heats of formation of CCCN and HCCCN Journal of Chemical Physics. 101: 7707-7711. DOI: 10.1063/1.468264 |
0.365 |
|
1994 |
Dibble TS, Francisco JS, Deeth RJ, Hand MR, Williams IH. Complete active space self-consistent field and density functional study of FNO The Journal of Chemical Physics. 100: 459-463. DOI: 10.1063/1.466960 |
0.332 |
|
1994 |
Francisco JS. A computational study of the reaction of the FO radical with H2 Journal of Chemical Physics. 100: 2896-2899. DOI: 10.1063/1.466431 |
0.401 |
|
1994 |
Francisco JS, Sander SP, Lee TJ, Rendell AP. Structures, Relative Stabilities, And Spectra Of Isomers Of Hclo2 The Journal of Physical Chemistry. 98: 5644-5649. DOI: 10.1021/J100073A012 |
0.46 |
|
1993 |
Maricq MM, Szente JJ, Khitrov GA, Francisco JS. Temperature dependent kinetics of the formation and self‐reactions of FC(O)O2 and FC(O)O radicals Journal of Chemical Physics. 98: 9522-9531. DOI: 10.1063/1.464383 |
0.324 |
|
1993 |
Maricq MM, Szente JJ, Li Z, Francisco JS. Visible absorption spectroscopy of the B 2A1–X 2B2 transition of fluoroformyloxyl radical, FC(O)O Journal of Chemical Physics. 98: 784-790. DOI: 10.1063/1.464241 |
0.348 |
|
1991 |
McKay RI, Uichanco AS, Bradley AJ, Holdsworth JR, Francisco JS, Steinfeld JI, Knight AEW. Direct observation of silicon (3P) following state‐selected photofragmentation of à 1B1 silylene Journal of Chemical Physics. 95: 1688-1695. DOI: 10.1063/1.461019 |
0.533 |
|
1989 |
Li Z, Francisco JS. Dissociation dynamics of perhaloalkoxy radicals Journal of the American Chemical Society. 111: 5660-5667. DOI: 10.1021/Ja00197A024 |
0.346 |
|
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