Chang Liu
9PUBLICATIONS
25CO-AUTHORS
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Publications (9)
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|Jan 29, 2025
MLTB: Enhancing Transferability and Extensibility of Density Functional Tight-Binding Theory with Many-body Interaction Corrections.Daniel J Burrill, Chang Liu, Michael G Taylor
|Jul 11, 2024
Efficient Parameterization of Density Functional Tight-Binding for 5f-Elements: A Th-O Case Study.Chang Liu, Néstor F Aguirre, Marc J Cawkwell
|Jun 03, 2024
Enhancing Molecular Energy Predictions with Physically Constrained Modifications to the Neural Network Potential.Weiqiang Fu, Yujie Mo, Yi Xiao
|Sep 10, 2021
Are all charge-transfer parameters created equally? A study of functional dependence and excited-state charge-transfer quantification across two dye families.Richard Drew Marshburn, Daniel C Ashley, Gregory M Curtin
|Nov 09, 2020
SCC-DFTB Parameters for Fe-C Interactions.Chang Liu, Enrique R Batista, Néstor F Aguirre
|Oct 22, 2019
Approximating Periodic Potential Energy Surfaces with Sparse Trigonometric Interpolation.Zachary Morrow, Chang Liu, C T Kelley
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Frequent Collaborators
6 joint publications
Elena Jakubikova
3 joint publications
Marc J Cawkwell
3 joint publications
Ping Yang
3 joint publications
Enrique R Batista
2 joint publications
C T Kelley
1 joint publications
Alexander Britz
1 joint publications
Wojciech Gawelda
1 joint publications
Mátyás Pápai
1 joint publications
Dorottya Sárosiné Szemes
1 joint publications
Nicholas Lubbers
