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MURI
Multidisciplinary University Research Initiative
Accurate Theoretical Predictions of the Properites of Energetic Materials
Preprints
- More Reliable Partial Atomic Charges When Using Diffuse Basis Sets (Jason D. Thompson, James D. Xidos, Timothy M. Sonbuchner, Christopher J. Cramer*, and Donald G. Truhlar*)
- Charge Model 3:A Class IV Charge Model Based on Hybrid Density Functional Theory with Variable Exchange (Paul Winget, Jason D. Thompson, James D. Xidos, Christopher J. Cramer*, and Donald G. Truhlar*)
- Charge Model 3: A Class IV Charge Model Based on Hybrid Density Functional Theory with Variable Exchange (Supporting information) (Paul Winget, Jason D. Thompson, James D. Xidos, Christopher J. Cramer*, and Donald G. Truhlar*)
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Donald L. Thompson's Theoretical Chemistry Group
