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Wenbo Sun

5PUBLICATIONS

23CO-AUTHORS

Theoretical quantum chemistryStructural properties of condensed matterComputational physiologyComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Organic semiconductors

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Publications (5)

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|May 08, 2025

Hybrid Functional DFTB Parametrizations for Modeling Organic Photovoltaic Systems.

Wenbo Sun, Tammo van der Heide, Van-Quan Vuong

|Nov 16, 2023

Benchmark Data Set of Crystalline Organic Semiconductors.

Andriy Zhugayevych, Wenbo Sun, Tammo van der Heide

|Jun 23, 2023

Machine Learning Enhanced DFTB Method for Periodic Systems: Learning from Electronic Density of States.

Wenbo Sun, Guozheng Fan, Tammo van der Heide

|Jan 21, 2023

TBMaLT, a flexible toolkit for combining tight-binding and machine learning.

A McSloy, G Fan, W Sun

|Nov 15, 2019

Machine learning-assisted molecular design and efficiency prediction for high-performance organic photovoltaic materials.

Wenbo Sun, Yujie Zheng, Ke Yang

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Frequent Collaborators

3 joint publications

Bálint Aradi

3 joint publications

Tammo van der Heide

2 joint publications

Guozheng Fan

2 joint publications

Carlos R Lien-Medrano

1 joint publications

A McSloy

1 joint publications

C Hölzer

1 joint publications

Van-Quan Vuong

1 joint publications

S Ehlert

1 joint publications

N-E Schütte

1 joint publications

S Grimme

Frequent Collaborators

3 joint publications

Bálint Aradi

3 joint publications

Tammo van der Heide

2 joint publications

Guozheng Fan

2 joint publications

Carlos R Lien-Medrano

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