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Chang Liu

9PUBLICATIONS

25CO-AUTHORS

Computational physiologyStatistical mechanics, physical combinatorics and mathematical aspects of condensed matterChemical engineering designTheoretical quantum chemistryMedical biochemistry - inorganic elements and compounds

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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 5<i>f</i>-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

Frequent Collaborators

6 joint publications

Elena Jakubikova

3 joint publications

Marc J Cawkwell

3 joint publications

Ping Yang

3 joint publications

Enrique R Batista

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