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Example Questions
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Matter Modeling: How to choose pseudo potential in frozen core electronic structure calcualations in material modeling?
10
Matter Modeling: How to determine cut off energy in plane wave calculations for periodic systems in material modeling
10
Matter Modeling: What is the largest system that current STEOM-CC could investigate.
9
Matter Modeling: What is the common method used to find transition states in material modeling?
0
Matter Modeling: How to optimize exchange correlation functional (XC) in DFT electronic structure calculations in materials modeling?