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Slideshow

Rathnaweera Receives Best Poster Award from Materials Research Society

Harshani Rathnaweera, a UGA Chemistry graduate student in the Salguero laboratory, was one of the Materials Research Society’s “Best Poster Winners” at the 2020 Virtual Fall Meeting. Her poster “2D Nanostructured Tetrasilicates with Cr(II) and Cr(II)/Fe(II) in Square-Planar Coordination” described her research on the synthesis, crystal growth, properties, and nanostructuring of metal chromium tetrasilicate materials ACrSi4O10 (A = Ca, Sr, Ba) with interesting magnetic properties.

Photochemical Synthesis and Spectroscopy of Polycyclic Aromatic Hydrocarbon Dimers

Laser desorption time-of-flight mass spectrometry (LD-ToF-MS) experiments on pressed-pellet samples of polycyclic aromatic hydrocarbons (PAHs) produce covalently-bonded dimers at masses (m/z) of 2M-2 and 2M-4 (where M is the parent mass). Through replication of these LD-ToF-MS conditions at higher throughput, PAH dimers have been produced and collected in milligram quantities. For collected samples of pyrene, perylene, and coronene, differential sublimation has isolated the dimer sample from residual monome

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Experimental Catalyst Design Aided by Machine Learning

In the past, catalyst design has been highly characterized by trial and error based on previous experience and knowledge of catalysis.1 Due to the number of variables involved in catalyst performance, it is difficult to manually optimize highly active catalysts. In the past few years, there has been a movement toward the use of machine learning as a tool in experimental catalyst design.

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Insights Into Molecular Structure Via Atomic Force Microscopy

Accurately characterizing the structure of molecules is a fundamental goal for chemists. Many powerful techniques exist to do so (e.g. NMR, IR Spectroscopy, X-ray Crystallography, etc.) and have proven themselves to be extremely effective. However, there are certain cases where these standard ensemble methods struggle to characterize certain systems. In 1986, Binning and coworkers developed Atomic Force Microscopy (AFM) as a complementary method to these traditional techniques.

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Coupled Cluster Externally Corrected by Adaptive Configuration Interaction

An externally corrected coupled cluster (CC) 1 method, where an adaptive configuration interaction (ACI) 2,3 wave function provides the external cluster amplitudes, named ACI-CC, was presented. By exploiting the connection between configuration interaction and coupled cluster through cluster analysis, the higher-order T3 and T4 terms obtained from ACI are used to augment the T1 and T2 amplitude equations from traditional coupled cluster.

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Gaseous SO2 and H2O Droplets: A Deep Dive Into Surface-level Interactions

The interactions between gaseous SO2 and the surface of water droplets have been studied extensively over the years due to the environmental impacts of aerosols. Spectroscopic methods including vibrational sum-frequency spectroscopy (VSFS) have been used to better understand the mechanism in which gaseous SO2 reacts and dissolves on a water droplet surface1-3. A weakly bonded SO2:H2O complex on the surface of water droplets has been observed before dissolution using VSFS1.

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Robinson Serves in Leading Role for STEM Diversity Initiative

Dr. Gregory Robinson, UGA Foundation Professor of Chemistry, is the lead faculty member coordinating the University of Georgia's participation in a comprehensive effort to increase faculty diversity and the use of inclusive teaching practices in STEM fields. Robinson is part of a team composed of UGA faculty, staff, and administrators working with the IChange Network to spearhead this initiative.

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