All-in-one driver: What do groups 11 and 16 have in common?
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The Department of Chemistry seeks to provide students with a foundation in the fundamentals and application of chemical theories and processes of the lab. Thus prepared they me pursue careers as teachers, industry supervisors, or research chemists in a variety of domains (governmental, academic, etc).
History
The Department of Chemistry was founded in 1880.
Dates of Existence
1880-present
Related Units
- College of Liberal Arts and Sciences (parent college)
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Abstract
This thesis is divided into two parts. The first part describes a theoretical
study on the interaction between Group 11 metals and adsorbates (mainly sulfur),
accompanied phenomena such as site preference of sulfur adsorbates, and formation of
metal-adsorbate complexes using density functional theory (DFT). The second part
describes a program development called the quantum chemistry common driver and
databases (QCDB), which contributes to the improvement of interoperability for quantum
chemistry software.