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Fenglong Gu

32PUBLICATIONS
46CO-AUTHORS
Theoretical quantum chemistryMetal organic frameworksFunctional materialsMathematical aspects of classical mechanics, quantum mechanics and quantum information theoryPolymerisation mechanisms
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Journal

Publications (32)

Sort by Publication Date:
|Jan 21, 2026
Correction to "Electronic Excitation Energy Calculations with Configuration Interaction Based on Nonorthogonal Localized Molecular Orbitals".

Feng Long Gu, Daoling Peng, Liang Peng

|Jan 19, 2026
Correction to "Regularized Localized Molecular Orbitals in a Divide-and-Conquer Approach for Linear Scaling Calculations".

Liang Peng, Daoling Peng, Feng Long Gu

|Dec 29, 2025
Understanding of molecular motions in nonadiabatic photoisomerization dynamics of cis-stilbene with on-the-fly simulation of transient absorption pump-probe spectra.

Juanjuan Zhang, Hangxu Liu, Congru Lin

|Nov 20, 2025
Electronic Excitation Energy Calculations with Configuration Interaction Based on Nonorthogonal Localized Molecular Orbitals.

Feng Long Gu, Daoling Peng, Liang Peng

|Jun 10, 2025
Theoretical prediction of pressure-stabilized all-nitrogen N<sub>12</sub> molecular crystals with π-π stacking.

Lei Zhao, Zelin Ma, Daoling Peng

|Feb 19, 2025
Nonlinear Optics Materials Designed by Intramolecular Boron- and Nitrogen-Locking Strategies: Exploring Torsion Angle Descriptors.

Bo Li, Shichen Lin, Feng Long Gu

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Frequent Collaborators

8 joint publications

Zhenggang Lan

6 joint publications

Bo Li

5 joint publications

Chaoyuan Zhu

5 joint publications

Chao Xu

5 joint publications

Chao Xu

4 joint publications

Weitao Yang

4 joint publications

Kunni Lin

3 joint publications

WenCai Yi

3 joint publications

Maxim F Gelin

2 joint publications

Hujun Shen

Frequent Collaborators

8 joint publications

Zhenggang Lan

6 joint publications

Bo Li

5 joint publications

Chaoyuan Zhu

5 joint publications

Chao Xu

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