Imaging covalent bond formation by H atom scattering from graphene von Jiang, Hongyan, Kammler, Marvin, Ding, Feizhi, Dorenkamp, Yvonne, Manby, Frederick R., Wodtke, Alec. M., Miller, Thomas F., Kandratsenka, Alexander, Bünermann, Oliver

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Quantum coherent plasmon in silver nanowires: a real-time TDDFT study von Ding, Feizhi, Guidez, Emilie B, Aikens, Christine M, Li, Xiaosong

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Molecular Engineered Hole‐Extraction Materials to Enable Dopant‐Free, Efficient p‐i‐n Perovskite Solar Cells von Chen, Huanle, Fu, Weifei, Huang, Chuyi, Zhang, Zhongqiang, Li, Shuixing, Ding, Feizhi, Shi, Minmin, Li, Chang‐Zhi, Jen, Alex K.‐Y., Chen, Hongzheng

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OrbNet Denali: A machine learning potential for biological and organic chemistry with semi-empirical cost and DFT accuracy von Christensen, Anders S., Sirumalla, Sai Krishna, Qiao, Zhuoran, O’Connor, Michael B., Smith, Daniel G. A., Ding, Feizhi, Bygrave, Peter J., Anandkumar, Animashree, Welborn, Matthew, Manby, Frederick R., Miller, Thomas F.

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Stability of the complex generalized Hartree-Fock equations von Goings, Joshua J, Ding, Feizhi, Frisch, Michael J, Li, Xiaosong

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Doping of Fullerenes via Anion-Induced Electron Transfer and Its Implication for Surfactant Facilitated High Performance Polymer Solar Cells von Li, Chang-Zhi, Chueh, Chu-Chen, Ding, Feizhi, Yip, Hin-Lap, Liang, Po-Wei, Li, Xiaosong, Jen, Alex K.-Y.

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Analytical gradients for projection-based wavefunction-in-DFT embedding von Lee, Sebastian J. R., Ding, Feizhi, Manby, Frederick R., Miller, Thomas F.

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Analytical gradients for molecular-orbital-based machine learning von Lee, Sebastian J. R., Husch, Tamara, Ding, Feizhi, Miller, Thomas F.

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Time-dependent non-equilibrium dielectric response in QM/continuum approaches von Ding, Feizhi, Lingerfelt, David B, Mennucci, Benedetta, Li, Xiaosong

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Solution-Processible Highly Conducting Fullerenes von Li, Chang-Zhi, Chueh, Chu-Chen, Yip, Hin-Lap, Ding, Feizhi, Li, Xiaosong, Jen, Alex K.-Y.

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An efficient method for calculating dynamical hyperpolarizabilities using real-time time-dependent density functional theory von Ding, Feizhi, Van Kuiken, Benjamin E, Eichinger, Bruce E, Li, Xiaosong

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Ab initio two-component Ehrenfest dynamics von Ding, Feizhi, Goings, Joshua J, Liu, Hongbin, Lingerfelt, David B, Li, Xiaosong

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Aromatic thiol-mediated cleavage of N–O bonds enables chemical ubiquitylation of folded proteins von Weller, Caroline E., Dhall, Abhinav, Ding, Feizhi, Linares, Edlaine, Whedon, Samuel D., Senger, Nicholas A., Tyson, Elizabeth L., Bagert, John D., Li, Xiaosong, Augusto, Ohara, Chatterjee, Champak

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Highly Sensitive Built-In Strain Sensors for Polymer Composites: Fluorescence Turn-On Response through Mechanochemical Activation von Li, Zhong'an, Toivola, Ryan, Ding, Feizhi, Yang, Jeffrey, Lai, Po-Ni, Howie, Tucker, Georgeson, Gary, Jang, Sei-Hum, Li, Xiaosong, Flinn, Brian D., Jen, Alex K.-Y.

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Thermodynamics of Hydrogen Atom Transfer to a High-Valent Iron Imido Complex von Nieto, Ismael, Ding, Feizhi, Bontchev, Ranko P, Wang, Haobin, Smith, Jeremy M

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Ab initio non-relativistic spin dynamics von Ding, Feizhi, Goings, Joshua J, Frisch, Michael J, Li, Xiaosong

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Doping Versatile n‑Type Organic Semiconductors via Room Temperature Solution-Processable Anionic Dopants von Chueh, Chu-Chen, Li, Chang-Zhi, Ding, Feizhi, Li, Zhong’an, Cernetic, Nathan, Li, Xiaosong, Jen, Alex K.-Y

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Approximate singly excited states from a two-component Hartree-Fock reference von Goings, Joshua J, Ding, Feizhi, Davidson, Ernest R, Li, Xiaosong

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Computational Study of Bridge-Assisted Intervalence Electron Transfer von Ding, Feizhi, Wang, Haobin, Wu, Qin, Van Voorhis, Troy, Chen, Shaowei, Konopelski, Joseph P

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First-Principles Calculation of pKa Values for Organic Acids in Nonaqueous Solution von FEIZHI DING, SMITH, Jeremy M, HAOBIN WANG

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