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Slideshow

Designing Material Properties from Molecular Principles

Targeted design of electronic and magnetic properties in novel materials remains a critical bottleneck in the development of many next-generation electrical and electrochemical devices. In this talk, I will describe how the principles of molecular inorganic chemistry can be applied to systematically engineer materials hosting a diverse range of desired properties.

From Rare-Earth Extraction to Polymer Recycling: Innovations in Materials for Sustainability

The transition to a sustainable future requires innovative approaches in materials design, utilization, and recycling. In this talk, I will discuss two advancements at the intersection of polymer chemistry and sustainability: the development of metal-chelating polymers for rare-earth element (REE: La–Lu, Y, and Sc) extraction, and the synthesis of chemically recyclable polymers.

Hierarchical Molecular Design at Organic-Inorganic Hybrid Lattices

The pursuit of next-generation materials to address the energy and sustainability crisis hinges on hybrid crystalline systems, particularly layered lattices with well-defined organic-inorganic interfaces. These materials harness the vast chemical space of organics and the superior electronic, photonic, or catalytic performance of inorganics, making the assembly tunable and solution processable.

Fundamental Mechanisms in Sustainable Materials from Global Environment to Climate Change

Climate change and global air pollution are the world’s two most serious issues. Negative carbon and polluted air capture are critical strategies for addressing rising CO2 and air pollution levels. State-of-the-art materials design at the atomic level is in high demand, and their fundamental mechanism must be revealed using cutting-edge microscopic and spectroscopic methodologies. As a result, the utilization of sustainable materials (e.g.

Synthesis and Structure-Property Characterization of Lignin-Derived Thermoplastic Poly(ether ester)s

Semi-aromatic polyesters derived from petroleum are an important class of polymers that encompass a wide variety of thermal and mechanical properties. Unfortunately, replacing the aromatic component with cost-competitive bioderived monomers is an ongoing challenge. In this presentation, we describe the synthesis of nine different polyesters made from AB monomers that can be derived from lignin, and include full characterization of their thermal, mechanical, and rheological properties.

Recent Approaches to 2D and 3D Materials for Second Harmonic Generation

The second harmonic generation (SHG) is a nonlinear coherent second-order scattering process that causes frequency doubling of incident light. It is widely used in laser technology, spectroscopy, microscopy, wireless communication technology and fiber-optic communication systems. The main requirement for the SHG process is the noncentrosymmetry of the material, since the second-order susceptibility coefficient, which is responsible for the second harmonic generation, is zero in all centrosymmetric structures.

Convergent Ab Initio Analysis of the Multi-Channel HOBr + H Reaction

High-level potential energy surfaces for three reactions of hypobromous acid with atomic hydrogen were computed at the CCSDTQ/CBS//CCSDT(Q)/complete basis set level of theory. Focal point analysis was utilized to extrapolate energies and gradients for energetics and optimizations, respectively. The H attack at Br and subsequent Br–O cleavage were found to proceed barrierlessly. The slightly submerged transition state lies −0.2 kcal mol−1 lower in energy than the reactants and produces OH and HBr.
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Formation and Dissociation of Hydrocarbons Under Interstellar Conditions

Hydrocarbons of all shapes and sizes are found throughout the various stages of star- and planet formation. Recently, using radio astronomical observations, a variety of cyclic- and even polycyclic hydrocarbons have been detected in the very cold (10 K) Taurus molecular cloud. These detections challenge our understanding of the chemical formation mechanisms under these low-temperature and low-density conditions.

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Plasma-Assisted Catalysis for Ammonia Synthesis

Ammonia (NH3) is important in the production of many products including fertilizers, plastics, resins, synthetic fabrics, and explosives. At the industrial scale, NH3 is produced using the Haber–Bosch (H–B) process, which is typically carried out at high temperatures and pressures. This process produces over 300 million metric tons of carbon dioxide each year, and consumes 1-2% of the world’s energy supply.

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Assistant to the Department Head: Donna Spotts, 706-542-1919 

Main office phone: 706-542-1919 

Main Email: chem-web@franklin.uga.edu

Head of Chemistry: Prof. Jason Locklin