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Peng Gao

8PUBLICATIONS
11CO-AUTHORS
Electrical energy generation (incl. renewables, excl. photovoltaics)Elemental semiconductorsMolecular and organic electronicsCondensed matter modelling and density functional theoryTheoretical quantum chemistry
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Publications (8)

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|Mar 15, 2024
Investigation of the lattice thermal transport properties of Janus XClO (X = Cr, Ir) monolayers by first-principles calculations.

Peng Gao, Xihao Chen, Zonghang Liu

|Feb 01, 2023
Heat transport properties of novel carbon monolayer (net-Y): a comparative study with graphene.

Peng Gao, Xihao Chen, Ning Wang

|Sep 27, 2022
Lower thermal conductivity of body centered cubic carbon (C14): a comparative study with diamond.

Peng Gao, Xihao Chen, Jiwen Li

|Aug 12, 2022
Computational Evaluation of Al-Decorated g-CN Nanostructures as High-Performance Hydrogen-Storage Media.

Peng Gao, Xihao Chen, Jiwen Li

|Jun 07, 2021
Sub-Nanometer Pt Clusters on Defective NiFe LDH Nanosheets as Trifunctional Electrocatalysts for Water Splitting and Rechargeable Hybrid Sodium-Air Batteries.

Xueqing Yu, Junpo Guo, Bo Li

|Jun 04, 2021
A general QSPR protocol for the prediction of atomic/inter-atomic properties: a fragment based graph convolutional neural network (F-GCN).

Peng Gao, Jie Zhang, Hongbo Qiu

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Frequent Collaborators

4 joint publications

Xihao Chen

3 joint publications

Ning Wang

2 joint publications

Jie Zhang

2 joint publications

Fuqiang Zhai

1 joint publications

Qian Peng

1 joint publications

Vassiliki-Alexandra Glezakou

1 joint publications

Shuaifei Zhao

1 joint publications

Kwan San Hui

1 joint publications

Kwun Nam Hui

1 joint publications

Huaiyu Shao

Frequent Collaborators

4 joint publications

Xihao Chen

3 joint publications

Ning Wang

2 joint publications

Jie Zhang

2 joint publications

Fuqiang Zhai

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