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Publications by Alexis T. Bell

Atomistic Investigations of the Effects of Si/Al Ratio and Al Distribution on the Adsorption Selectivity of N-Alkanes in Brønsted-Acid Zeolites

Journal of Physical Chemistry C
SurfacesEnergyNanoscienceTheoretical ChemistryOpticalMagnetic MaterialsFilmsNanotechnologyElectronicCoatingsPhysical
2018English

The Role of Metal Halides in Enhancing the Dehydration of Xylose to Furfural

ChemCatChem
Organic ChemistryInorganic ChemistryCatalysisTheoretical ChemistryPhysical
2015English

The Role of Hydrogen During Pt–Ga Nanocatalyst Formation

Physical Chemistry Chemical Physics
Theoretical ChemistryAstronomyPhysicsPhysical
2016English

Improved United-Atom Force Field for 1-Alkyl-3-Methylimidazolium Chloride

Journal of Physical Chemistry B
SurfacesTheoretical ChemistryMaterials ChemistryFilmsMedicineCoatingsPhysical
2010English

Oxidative Dehydrogenation of Propane Over Vanadia–Magnesia Catalysts Prepared by Thermolysis of OV(OtBu)3 in the Presence of Nanocrystalline MgO

Journal of Catalysis
Theoretical ChemistryCatalysisPhysical
2002English

Studies of N2O Adsorption and Decomposition on Fe–ZSM-5

Journal of Catalysis
Theoretical ChemistryCatalysisPhysical
2002English

An Efficient Self-Consistent Field Method for Large Systems of Weakly Interacting Components

Journal of Chemical Physics
MedicineTheoretical ChemistryAstronomyPhysicsPhysical
2006English

Efficient Methods for Finding Transition States in Chemical Reactions: Comparison of Improved Dimer Method and Partitioned Rational Function Optimization Method

Journal of Chemical Physics
MedicineTheoretical ChemistryAstronomyPhysicsPhysical
2005English

Development and Application of a Hybrid Method Involving Interpolation and Ab Initio Calculations for the Determination of Transition States

Journal of Chemical Physics
MedicineTheoretical ChemistryAstronomyPhysicsPhysical
2008English

Density Functional Theory Calculations of the Oxidative Dehydrogenation of Propane on the (010) Surface of V2O5†

Journal of Physical Chemistry B
SurfacesTheoretical ChemistryMaterials ChemistryFilmsMedicineCoatingsPhysical
2000English

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