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Kylin 1.0: An Ab-Initio Density Matrix Renormalization Group Quantum Chemistry Program

Zhaoxuan Xie, Yinxuan Song, Fangwen Peng, Jianhao Li, Yifan Cheng, Lingzhi Zhang, Yingjin Ma, Yingqi Tian, Zhen Luo, Haibo Ma

Version 1 posted 29 November 2022

362

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Organic Chemistry

Working Paper

Stair-Like Narrow Nanographene with Diradicaloid Character at the Topological Interface

Zuhao Li, Yue Tang, Jing Guo, Jun Zhang, Wang Xiao, Yifan Yao, Sheng Xie, Zebing Zeng

Version 1 posted 02 September 2022

352

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Catalysis

Working Paper

Abiotic sugar synthesis from CO2 electrolysis

Stefano Cestellos-Blanco, Sheena Louisia, Michael Ross, Yifan Li, Tyler Detomasi, Jessica Cestellos Spradlin, Daniel Nomura, Peidong Yang

Version 1 posted 09 December 2021

1,169

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Physical Chemistry

Working Paper

Direct Structure Determination from Spherulites using 3D Electron Diffraction

Shuting Li, Molly Lightowler, Xiao Ou, Siyong Huang, Yifan Jiang, Xizhen Li, Xiaodong Zou, Hongyi Xu, Ming Lu

Version 1 posted 24 May 2022

447

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1

Citations

Catalysis

Working Paper

The presence and role of the intermediary CO reservoir in heterogeneous electroreduction of CO2

Sheena Louisia, Dohyung Kim, Yifan Li, Mengyu Gao, Sunmoon Yu, Peidong Yang

Version 1 posted 05 August 2021

775

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Catalysis

Working Paper

Untethering sparteine: 1,3-diamine ligand for asymmetric synthesis in water

Fanyun Zeng, Chen Chen, Liu Liu, Yifan Li, Bo Li, Guotao Lin, Shihao Huang, Mingyu Zhang, Yuting Yan, Yuan Zhang, Yanfeng Dang, Jianhui Huang

Version 3 posted 29 October 2021

1,190

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1

Citations

Materials Chemistry

Working Paper

Scalable and low-energy decoupled electrochemical CO2 capture

Tao Liu, Yifan Wu, Yunpeng Wang, Wenchuan Jiang, Yuchao Deng, Qing Li, Cheng Lan, Zhiyu Zhao, Liangyu Zhu, Dongsheng Yang, Heping Xie

Version 1 posted 12 January 2024

265

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Polymer Science

Working Paper

Radical Homopolymerization of Linear α-Olefins Enabled by Cyano Group Migration

Bang An, Litao Zhou, Shuai Liu, Feichen Cui, Jiajun Yan, Yifan Li

Version 1 posted 16 November 2023

301

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Theoretical and Computational Chemistry

Working Paper

Conformational Isomerization of the Fe(III)-OH Species Enables Selective Halogenation in Non-Heme Iron Halogenase BesD and Hydroxylase-Evolved Halogenase

Jinyan Zhang, Yifan Li, Wenli Yuan, Xuan Zhang, Yubing Si, Binju Wang

Version 1 posted 16 April 2024

154

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Materials Science

Working Paper

RFNET: Integrating Rich Features into Neural Networks for Band Gap Prediction of Perovskite Crystals

Kun Zhang, Yang Yu, Minyan Li, Yifan Pang, Zhi Xu, Tao You, Kai Wang, Hui Liu

Version 1 posted 07 February 2023

250

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10 results in Yifan Li in Authors: Yifan Li

Kylin 1.0: An Ab-Initio Density Matrix Renormalization Group Quantum Chemistry Program

Stair-Like Narrow Nanographene with Diradicaloid Character at the Topological Interface

Abiotic sugar synthesis from CO2 electrolysis

Direct Structure Determination from Spherulites using 3D Electron Diffraction

The presence and role of the intermediary CO reservoir in heterogeneous electroreduction of CO2

Untethering sparteine: 1,3-diamine ligand for asymmetric synthesis in water

Scalable and low-energy decoupled electrochemical CO2 capture

Radical Homopolymerization of Linear α-Olefins Enabled by Cyano Group Migration

Conformational Isomerization of the Fe(III)-OH Species Enables Selective Halogenation in Non-Heme Iron Halogenase BesD and Hydroxylase-Evolved Halogenase

RFNET: Integrating Rich Features into Neural Networks for Band Gap Prediction of Perovskite Crystals

10 results in Authors: Yifan Li