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Theoretical and Computational Chemistry

Working Paper

Excitonic Coupled-cluster Theory: Part I, General Formalism

Yuhong Liu, Anthony Dutoi

Version 2 posted 28 August 2017

1,143

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Physical Chemistry

Working Paper

Discovery of Superbroad Mid-Infrared Luminescent Metal-Organic Framework Glass

Mohamed. A. Ali, Jinjun Ren, Xiaofeng Liu, Youjie Hua, Yuanzheng Yue, Qiu Jianrong

Version 1 posted 28 January 2019

956

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Polymer Science

Working Paper

SuFExable Polymers with Helical Structures Derived from Thionyl Tetrafluoride (SOF4)

Suhua Li, Gencheng Li, Bing Gao, Sidharam P. Pujari, Xiaoyan Chen, Hyunseok Kim, Feng Zhou, Liana M. Klivansky, Yi Liu, Hafedh Driss, Rachael E. Impey, Tatiana P. Soares da Costa, Jianmei Lu, Peng Wu, Han Zuilhof, John E. Moses, K. Barry Sharpless

Version 1 posted 23 October 2019

1,080

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Materials Science

Working Paper

Branched Kissing Loops for the Construction of Diverse RNA Homooligomeric Nanostructures

Di Liu, Cody Geary, Gang Chen, Yaming Shao, Mo Li, Chengde Mao, Ebbe S. Andersen, Joseph A. Piccirilli, Paul W. K. Rothemund, Yossi Weizmann

Version 1 posted 14 March 2019

925

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Organic Chemistry

Working Paper

Cascade CuH-Catalyzed Conversion of Alkynes to Enantioenriched 1,1-Disubstituted Products

De-Wei Gao, Yang Gao, Huiling Shao, Tian-Zhang Qiao, Xin Wang, Brittany Sanchez, Jason Chen, Peng Liu, Keary Engle

Version 1 posted 09 April 2019

1,467

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Theoretical and Computational Chemistry

Working Paper

Machine Learning Enabled Capacitance Prediction for Carbon-Based Supercapacitors

Shan Zhu, Jiajun Li, Liying Ma, Chunnian He, Enzuo Liu, Fang He, Chunsheng Shi, Naiqin Zhao

Version 2 posted 07 May 2018

1,294

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1

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Physical Chemistry

Working Paper

The Role of Sodium Sulfate Supporting Electrolyte in Ammonium Transport and Reduction at Interface Between Platinum Cathode and Solution

Linji Xu, Yunsong Pang, Dezhao Huang, Huichuan Zhuang, Wenzong Liu, Tengfei Luo, Po-Heng Lee, Li Feng, Junchi Lu

Version 1 posted 23 October 2019

638

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Chemical Engineering and Industrial Chemistry

Working Paper

Tailorable Phase and Structural MnO2 as Electrode for Highly Efficient Hybrid Capacitive Desalination (HCDI)

Jie Jin, Man Li, Mengting Tang, Yang Li, Yangyang Liu, Hui Cao, Feihu Li

Version 1 posted 25 November 2019

902

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Analytical Chemistry

Working Paper

GenUI: Interactive and Extensible Open Source Software Platform for De Novo Molecular Generation

Martin Šícho, Xuhan Liu, Daniel Svozil, Gerard van Westen

Version 2 posted 08 June 2021

1,045

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Theoretical and Computational Chemistry

Working Paper

Excitonic Coupled-cluster Theory: Part II, Electronic Hamiltonian

Anthony Dutoi, Yuhong Liu

Version 2 posted 28 August 2017

1,153

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Refine Search

1219 results in Liu Liu in Authors: Liu Liu

Excitonic Coupled-cluster Theory: Part I, General Formalism

Discovery of Superbroad Mid-Infrared Luminescent Metal-Organic Framework Glass

SuFExable Polymers with Helical Structures Derived from Thionyl Tetrafluoride (SOF4)

Branched Kissing Loops for the Construction of Diverse RNA Homooligomeric Nanostructures

Cascade CuH-Catalyzed Conversion of Alkynes to Enantioenriched 1,1-Disubstituted Products

Machine Learning Enabled Capacitance Prediction for Carbon-Based Supercapacitors

The Role of Sodium Sulfate Supporting Electrolyte in Ammonium Transport and Reduction at Interface Between Platinum Cathode and Solution

Tailorable Phase and Structural MnO2 as Electrode for Highly Efficient Hybrid Capacitive Desalination (HCDI)

GenUI: Interactive and Extensible Open Source Software Platform for De Novo Molecular Generation

Excitonic Coupled-cluster Theory: Part II, Electronic Hamiltonian

1219 results in Authors: Liu Liu