2022 Quantum Chemistry Workshop
The Department of Chemistry in collaboration with Lehigh University Research Computing is pleased to announce the 2nd Annual Lehigh Quantum Chemistry Workshop on June 9-10, 2022. This workshop will be held in STEPS 121 (in-person only) and open to all Lehigh undergraduate and graduate students, postdocs, Faculty, and staff.
This workshop will discuss using GaussView and Gaussian16 to run various molecular calculations on the Sol Cluster.
Click here to register.
Schedule
Day | Time | Topic |
|---|---|---|
June 9, 2022 | 10AM - Noon | Introduction to Basic Linux commands and practice |
| Noon - 1PM | Lunch Break |
| 1PM - 2PM | |
| 2PM - 4PM | Linux and SLURM practice |
June 10, 2022 | 10AM - 11AM | |
| 11AM - Noon | Creating Gaussian input files and practice |
| Noon - 1PM | Lunch Break |
| 1PM - 2PM | Running using HPC and practice |
| 2PM - 4PM | Calculating chemistry properties and data analysis |