UNT College of Arts and Sciences - 810 Matching Results

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Computational studies of the potential energy surface for O(¹D) + H₂S: Characterization of pathways involving H₂SO, HOSH, and H₂OS

Article on computational studies of the potential energy surface for O(¹D) + H₂S and the characterization of pathways involving H₂SO, HOSH, and H₂OS.

Date: December 1, 1994

Creator: Goumri, Abdellatif; Rocha, John-David Ray; Laakso, Dianna; Smith, C. E. & Marshall, Paul

Item Type: Article

open access

Computational studies of the reactions of CH3I with H and OH

Article on computational studies of the reactions of CH3I with H and OH.

Date: March 26, 1998

Creator: Marshall, Paul; Misra, Ashutosh & Berry, Rajiv

Item Type: Article

open access

Computational Studies of the Thermochemistry of the Atmospheric Iodine Reservoirs HOI and IONO₂

Book chapter discussing computational studies of the thermochemistry of the atmospheric iodine reservoirs HOI and IONO₂.

Date: April 26, 2008

Creator: Marshall, Paul

Item Type: Book Chapter

open access

A Computational Study of Adducts Between Atomic Chlorine and Carbon Dioxide, Carbonyl Sulfide and Carbon Disulfide

Article on a computational study of adducts between atomic chlorine and carbon dioxide, carbonyl sulfide and carbon disulfide.

Date: November 15, 1991

Creator: Marshall, Paul

Item Type: Article

open access

Computational Study of C-H Bond Strengths in Polyfluoroalkanes

Article on a computational study of C-H bond strengths in polyfluoroalkanes.

Date: April 10, 1997

Creator: Marshall, Paul & Schwartz, Martin

Item Type: Article

open access

A computational study of chlorofluoro-methyl radicals

Article on a computational study of chlorofluoro-methyl radicals.

Date: January 8, 2003

Creator: Schwartz, Martin; Peebles, Lynda R.; Berry, Rajiv & Marshall, Paul

Item Type: Article

open access

Computational Study of Polarizabilities and Second Hyperpolarizabilities of Inorganic Transition Metal Thiometalates and Metalates in Solution

This article discusses a computational study of polarizabilities and second hyperpolarizabilities of inorganic transition metal thiometalates and metalates in solution.

Date: March 8, 2000

Creator: Cundari, Thomas R., 1964-; Kurtz, Henry A. & Zhou, Tie

Item Type: Article

open access

A computational study of the enthalpies of formation of halomethylidynes

Article on a computational study of the enthalpies of formation of halomethylidynes.

Date: January 22, 1999

Creator: Marshall, Paul; Misra, Ashutosh & Schwartz, Martin

Item Type: Article

open access

Computational Study of the Kinetics of Hydrogen Abstraction from Fluoromethanes by the Hydroxyl Radical

Article on a computational study of the kinetics of hydrogen abstraction from fluoromethanes by the hydroxyl radical.

Date: November 13, 1998

Creator: Schwartz, Martin; Marshall, Paul; Berry, Rajiv; Ehlers, C. J. & Petersson, George A.

Item Type: Article

open access

A computational study of the reaction kinetics of methyl radicals with trifluorohalomethanes

This article discusses a computational study of the reaction kinetics of methyl radicals with trifluorohalomethanes.

Date: January 6, 1999

Creator: Berry, Rajiv & Marshall, Paul

Item Type: Article

open access

A Computational Study of the Reactions of Atomic Hydrogen with Fluoromethanes: Kinetics and Product Channels

This article discusses a computational study of the reactions of atomic hydrogen with fluoromethanes and kinetics and product channels.

Date: April 25, 1997

Creator: Berry, Rajiv; Ehlers, C. J.; Burgess, Donald R.; Zachariah, Michael Russel, 1957- & Marshall, Paul

Item Type: Article

open access

A computational study of the thermochemistry of bromine- and iodine-containing methanes and methyl radicals

Article on a computational study of the thermochemistry of bromine- and iodine-containing methanes and methyl radicals.

Date: June 28, 2005

Creator: Marshall, Paul; Srinivas, G. N. & Schwartz, Martin

Item Type: Article

Computational Study of the Thermochemistry of N₂O₅ and the Kinetics of the Reaction N₂O₅ + H₂O → 2 HNO₃

Article on a computational study of the thermochemistry of N₂O₅ and the Kinetics of the Reaction N₂O₅ + H₂O → 2 HNO₃.

Date: November 7, 2014

Creator: Alecu, I. M. & Marshall, Paul

Item Type: Article

open access

Conductor Structures Including Penetrable Materials

Patent relating to conductors used in electronic components and related fabrication methods, and more particularly to metal conductors for use in electronic components created by deposition of metals and related fabrication methods.

Date: May 19, 2009

Creator: Kelber, Jeffry A.; Lei, Jipu; Magtoto, Noel P. & Rudenja, Sergei

Item Type: Patent

open access

Controlled Depositions of Metal and Metal Cluster Ions by Surface Field Patterning in Soft-Landing Devices

Patent relating to controlled deposition of metal and metal cluster ions by surface field patterning in soft-landing devices.

Date: February 18, 2014

Creator: Verbeck, Guido F. & Davila, Stephen

Item Type: Patent

open access

Conversions of Ruthenium (III) Alkyl Complexes to Ruthenium (II) through Ru-Calkyl Bond Homolysis

This article discusses conversions of Ruthenium(III) alkyl complexes.

Date: February 12, 2005

Creator: Lail, Marty; Gunnoe, T. Brent; Barakat, Khaldoon A. & Cundari, Thomas R., 1964-

Item Type: Article

open access

Cooperative Carbon Capture Capabilities in Multivariate MOFs Decorated with Amino Acid Side Chains: A Computational Study

This article discusses cooperative carbon capture capabilities in metal organic frameworks decorated with amino acid side chains.

Date: June 5, 2013

Creator: Drummond, Michael L.; Cundari, Thomas R., 1964- & Wilson, Angela K.

Item Type: Article

open access

Cooperative Effects in the Annelation of Benzene by Multiple Etheno Groups

Article on cooperative effects in the annelation of benzene by multiple etheno groups.

Date: April 20, 2011

Creator: Bao, Xiaoguang; Hrovat, David A. & Borden, Weston T.

Item Type: Article

open access

Cooperativity Between Low-Valent Iron and Potassium Promoters in Dinitrogen Fixation

Article discussing the cooperativity between low-valent iron and potassium promoters in dinitrogen fixation.

Date: June 26, 2012

Creator: Figg, Travis M.; Holland, Patrick L. & Cundari, Thomas R., 1964-

Item Type: Article

open access

Coordination Chemistry of 4-Methyl-2,6,7-trioxa-1-phosphabicyclo[2,2,1]heptane: Preparation and Characterization of Ru(II) Complexes

Article discussing preparation and characterization of Ru(II) complexes.

Date: March 27, 2012

Creator: Joslin, Evan E.; McMullin, Claire L.; Gunnoe, T. Brent; Cundari, Thomas R., 1964-; Sabat, Michal & Myers, William H.

Item Type: Article

open access

Correlation and Estimation of Aqueous Solubilities of Polycyclic Aromatic Hydrocarbons

Article on the correlation and estimation of aqueous solubilities of polycyclic aromatic hydrocarbons.

Date: 1984

Creator: Baker, Ronald J.; Acree, William E. (William Eugene) & Tsai, Chun-che

Item Type: Article

open access

Correlation and prediction of partition coefficient between the gas phase and water, and the solvents dry methyl acetate, dry and wet ethyl acetate, and dry and wet butyl acetate

Article discussing research on the correlation and prediction of partition coefficient between the gas phase and water, and the solvents dry methyl acetate, dry and wet ethyl acetate, and dry and wet butyl acetate.

Date: August 25, 2008

Creator: Sprunger, Laura M.; Proctor, Amy; Acree, William E. (William Eugene); Abraham, M. H. (Michael H.) & Benjellou-Dakhama, Nora

Item Type: Article

open access

Correlation and prediction of partition coefficients between the gas phase and water, and the solvents dodecane and undecane

Article on the correlation and prediction of partition coefficients between the gas phase and water, and the solvents dodecane and undecane.

Date: October 29, 2004

Creator: Abraham, M. H. (Michael H.) & Acree, William E. (William Eugene)

Item Type: Article

open access

Correlation and Prediction of Partition Coefficients from the Gas Phase and from Water to Alkan-1-ols

Article discussing correlation and prediction of partition coefficients from the gas phase and from water to alkan-1-ols.

Date: April 22, 2008

Creator: Abraham, M. H. (Michael H.); Nasezadeh, Asadollah & Acree, William E. (William Eugene)

Item Type: Article

UNT College of Arts and Sciences - 810 Matching Results

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Computational studies of the potential energy surface for O(¹D) + H₂S: Characterization of pathways involving H₂SO, HOSH, and H₂OS

Computational studies of the reactions of CH3I with H and OH

Computational Studies of the Thermochemistry of the Atmospheric Iodine Reservoirs HOI and IONO₂

A Computational Study of Adducts Between Atomic Chlorine and Carbon Dioxide, Carbonyl Sulfide and Carbon Disulfide

Computational Study of C-H Bond Strengths in Polyfluoroalkanes

A computational study of chlorofluoro-methyl radicals

Computational Study of Polarizabilities and Second Hyperpolarizabilities of Inorganic Transition Metal Thiometalates and Metalates in Solution

A computational study of the enthalpies of formation of halomethylidynes

Computational Study of the Kinetics of Hydrogen Abstraction from Fluoromethanes by the Hydroxyl Radical

A computational study of the reaction kinetics of methyl radicals with trifluorohalomethanes

A Computational Study of the Reactions of Atomic Hydrogen with Fluoromethanes: Kinetics and Product Channels

A computational study of the thermochemistry of bromine- and iodine-containing methanes and methyl radicals

Computational Study of the Thermochemistry of N₂O₅ and the Kinetics of the Reaction N₂O₅ + H₂O → 2 HNO₃

Conductor Structures Including Penetrable Materials

Controlled Depositions of Metal and Metal Cluster Ions by Surface Field Patterning in Soft-Landing Devices

Conversions of Ruthenium (III) Alkyl Complexes to Ruthenium (II) through Ru-Calkyl Bond Homolysis

Cooperative Carbon Capture Capabilities in Multivariate MOFs Decorated with Amino Acid Side Chains: A Computational Study

Cooperative Effects in the Annelation of Benzene by Multiple Etheno Groups

Cooperativity Between Low-Valent Iron and Potassium Promoters in Dinitrogen Fixation

Coordination Chemistry of 4-Methyl-2,6,7-trioxa-1-phosphabicyclo[2,2,1]heptane: Preparation and Characterization of Ru(II) Complexes

Correlation and Estimation of Aqueous Solubilities of Polycyclic Aromatic Hydrocarbons

Correlation and prediction of partition coefficient between the gas phase and water, and the solvents dry methyl acetate, dry and wet ethyl acetate, and dry and wet butyl acetate

Correlation and prediction of partition coefficients between the gas phase and water, and the solvents dodecane and undecane

Correlation and Prediction of Partition Coefficients from the Gas Phase and from Water to Alkan-1-ols