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Chemical Engineering and Industrial Chemistry

Intelligent Molecular Identification for High Performance Organosulfide Capture Using Active Machine Learning Algorithm

Yuxiang Chen, Chuanlei Liu, Yang An, Yue Lou, Yang Zhao, Cheng Qian, Hao Jiang, Kongguo Wu, Xianghui Zhang, Hui Sun, Di Wu, Benxian Shen, Fahai Cao

Version 1 posted 26 November 2021

196

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1

Citations

Theoretical and Computational Chemistry

Working Paper

Unraveling the Activity and Selectivity of CO2 Electrochemical Reduction on Single Atom Catalyst by Potential Based Scaling Relationship

Yang-Gang Wang, Hao Cao, Zisheng Zhang, Jie-Wei Chen

Version 1 posted 04 April 2022

429

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Analytical Chemistry

Working Paper

Does one need to polish electrodes in an eight pattern? Automation provides the answer.

Naruki Yoshikawa, Gun Deniz Akkoc, Sergio Pablo-García, Yang Cao, Han Hao, Alán Aspuru-Guzik

Version 1 posted 13 February 2024

367

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Catalysis

Working Paper

A spin promotion effect in catalytic ammonia synthesis

Ang Cao, Vanessa Jane Bukas, Vahid Shadravan, Zhenbin Wang, Jakob Kibsgaard, Hao Li, Ib Chorkendorff, Jens Kehlet Nørskov

Version 1 posted 28 February 2022

409

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Materials Chemistry

Working Paper

Narrowband Green Thermally-activated Delayed Fluorescence Emitters Based on Bis-fused Indolo[3,2,1-jk]carbazole with Peripheral Donor Decoration

Ke Zhang, Pingping Wang, Yuan Cao, Yongjun Song, Yue Xiu, Yibo Li, Hao Ren, Lei He, Dongdong Zhang, Lian Duan

Version 1 posted 19 February 2024

481

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Theoretical and Computational Chemistry

Working Paper

Growth of Polycyclic Aromatic Hydrocarbon and Soot Inception by in silico Simulation

Bo Wang, Jinzhe Zeng, Liqun Cao, Chih-Hao Chin, Darrin York, Tong Zhu, John Zhang

Version 1 posted 04 April 2022

406

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2

Citations

Materials Chemistry

Working Paper

Visible Organic Thermoluminescence above Room Temperature in Small Molecule Crystals

Yunsheng Wang, Jie Yang, Liwei Wang, Aisen Li, Yalei Cao, Xiaoze Wang, Manman Fang, Qiushui Chen, Huang-Hao Yang, Zhen Li

Version 1 posted 06 December 2023

377

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Nanoscience

Working Paper

Nano-Folded Gold Electrocatalysts Enhance the Selectivity of Carbon Dioxide Reduction

Kam Sang Kwok, Yuxuan Wang, Michael Cao, Hao Shen, Weinan Xu, David Muller, Chao Wang, David Gracias

Version 1 posted 20 June 2019

672

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Theoretical and Computational Chemistry

Working Paper

ReacNetGenerator: an Automatic Reaction Network Generator for Reactive Molecular Dynamic Simulations

Jinzhe Zeng, Liqun Cao, John ZH Zhang, Chih-Hao Chin, Tong Zhu

Version 3 posted 19 August 2019

1,606

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Theoretical and Computational Chemistry

Working Paper

Combustion Driven by Fragment-based Ab Initio Molecular Dynamics Simulation

Liqun Cao, Jinzhe Zeng, Mingyuan Xu, Chih-Hao Chin, Tong Zhu, John ZH Zhang

Version 1 posted 31 December 2019

477

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Refine Search

14 results in Hao Cao in Authors: Hao Cao

Intelligent Molecular Identification for High Performance Organosulfide Capture Using Active Machine Learning Algorithm

Unraveling the Activity and Selectivity of CO2 Electrochemical Reduction on Single Atom Catalyst by Potential Based Scaling Relationship

Does one need to polish electrodes in an eight pattern? Automation provides the answer.

A spin promotion effect in catalytic ammonia synthesis

Narrowband Green Thermally-activated Delayed Fluorescence Emitters Based on Bis-fused Indolo[3,2,1-jk]carbazole with Peripheral Donor Decoration

Growth of Polycyclic Aromatic Hydrocarbon and Soot Inception by in silico Simulation

Visible Organic Thermoluminescence above Room Temperature in Small Molecule Crystals

Nano-Folded Gold Electrocatalysts Enhance the Selectivity of Carbon Dioxide Reduction

ReacNetGenerator: an Automatic Reaction Network Generator for Reactive Molecular Dynamic Simulations

Combustion Driven by Fragment-based Ab Initio Molecular Dynamics Simulation

14 results in Authors: Hao Cao