Direct Experimental Observation of in situ Dehydrogenation of an Amine–Borane System Using Gas Electron Diffraction
AM Ja'o, SL Masters, DA Wann… - The Journal of …, 2019 - ACS Publications
In situ dehydrogenation of azetidine–BH3, which is a candidate for hydrogen storage, was
observed with the parent and dehydrogenated analogue subjected to rigorous structural and …
observed with the parent and dehydrogenated analogue subjected to rigorous structural and …
Effect of charge transfer on the first hyper-polarizability of N, N-dimethylaniline and julolidine: a DFT based comparative study
Context Quantum mechanical calculations involving electron correlation, frequency
dispersion, and solvent effects were carried out to examine the second-order nonlinear …
dispersion, and solvent effects were carried out to examine the second-order nonlinear …
Structural and thermochemical studies of pyrrolidine borane and piperidine borane by gas electron diffraction and quantum chemical calculations
The gaseous structures, thermochemical properties and dehydrogenation reaction energy
profiles of the borane complexes of pyrrolidine and piperidine have been investigated using …
profiles of the borane complexes of pyrrolidine and piperidine have been investigated using …
Utilizing the Combined Power of Theory and Experiment to Understand Molecular Structure–Solid-State and Gas-Phase Investigation of Morpholine Borane
M Aliyu, DA Wann, CD Rankine… - Australian Journal of …, 2020 - CSIRO Publishing
The molecular structure of morpholine borane complex has been studied in the solid state
and gas phase using single-crystal X-ray diffraction, gas electron diffraction, and …
and gas phase using single-crystal X-ray diffraction, gas electron diffraction, and …
Ultrafast and three-dimensional diffractive imaging of isolated molecules with electron pulses
JPF Nunes, M Centurion - Advances In Atomic, Molecular, and Optical …, 2019 - Elsevier
The conversion of light into other forms of energy at the molecular level is an essential
mechanism in some of nature's most ubiquitous processes, such as vision, photosynthesis …
mechanism in some of nature's most ubiquitous processes, such as vision, photosynthesis …
Volatile and Thermally Stable Polymeric Tin Trifluoroacetates
Tin trifluoroacetates are effective vapor phase single-source precursors for F-doped SnO2,
but their structures have been poorly understood for decades. Here we undertook a …
but their structures have been poorly understood for decades. Here we undertook a …
Designing New Atomic Layer Deposition Precursors for Third-Generation Photovoltaics
GI Bacic - 2021 - repository.library.carleton.ca
Atomic layer deposition (ALD) holds a critical position in nanofabrication because of its
uniformity, conformality, and subnanometer thickness control. Its abilities arise from its …
uniformity, conformality, and subnanometer thickness control. Its abilities arise from its …
Supramolecular Organization and Evaporation of Polymeric Tin Trifluoroacetates
G Bacic, CD Rankine, JD Masuda, DA Wann, S Barry - 2019 - chemrxiv.org
Simple tin carboxylates make up a family of important industrial catalysts and precursors for
deposition of SnO2 thin films. However, their structures remain disparately characterized …
deposition of SnO2 thin films. However, their structures remain disparately characterized …
Structure and Dynamics by Experiment and Theory: Concerted Applications of Gas Electron Diffraction and Computational Chemistry
CD Rankine - 2019 - etheses.whiterose.ac.uk
To plan and prepare the strongest research proposals for time-resolved gas electron
diffraction (TRGED) experiments, the author has launched and overseen the development of …
diffraction (TRGED) experiments, the author has launched and overseen the development of …