31 citations · 56 across the 3 of their papers we have counts for
3 papers
Enhancing the Accuracy of Density Functional Tight Binding Models Through ChIMES Many-body Interaction Potentials
Nir Goldman, Laurence E. Fried, Rebecca K. Lindsey +2
Semi-empirical quantum models such as Density Functional Tight Binding (DFTB) are attractive methods for obtaining quantum simulation data at longer time and length scales than pos…
Semi-Automated Creation of Density Functional Tight Binding Models Through Leveraging Chebyshev Polynomial-based Force Fields
Nir Goldman, Kyoung Eun Kweon, Babak Sadigh +8
Density Functional Tight Binding (DFTB) is an attractive method for accelerated quantum simulations of condensed matter due to its enhanced computational efficiency over standard D…
Structural study of TATB under detonation-induced shock conditions
Elissaios Stavrou, Michael Bagge-Hansen, Joshua A. Hammons +13
We explore the response of the insensitive high explosive (IHE) 1,3,5-Triamino-2,4,6- trinitrobenzene (TATB) under detonation-induced shock conditions using in-situ synchrotron X-r…