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Deyu Lu

brookhaven national laboratory

30H-index
179Paper Count
3.6KCitation Count
Published Papers 66
Publication Date
Deciphering the Solvation Structure of Aqueous ZnCl2 Solutions from X-ray Absorption Spectra Using the Interpretable Graph Neural Network
err2026-04-28
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PREAI
errChuntian Cao; Boyang Li; Armando Rodriguez Campos; Alexis Pace; Joshua J. Kas; Xifan Wu; Lu Ma; Dali Yang; Wei Xu; Shinjae Yoo; Esther S. Takeuchi; Kenneth J. Takeuchi; Shan Yan; Amy C. Marschilok; Deyu Lu
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Altermagnetism Induced Surface Chern Insulator
err2026-01-20
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PREAI
errXuance Jiang; Sayed Ali Akbar Ghorashi; Deyu Lu; Jennifer Cano
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Thermally driven surface phase separation in intermetallic alloys
err2025-12-14
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errOAAI
errShyam Bharatkumar Patel; Xiaobo Chen; Dongxiang Wu; Zhikang Zhou; Yupeng Wu; Yaguang Zhu; Chaoran Li; Xianhu Sun; Xiao Tong; Abdullah Al-Mahboob; Deyu Lu; Jorge Anibal Boscoboinik; Jerzy T. Sadowski; Guangwen Zhou
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Strain release through hydrogen bond–mediated layer twisting
err2025-10-31
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PREAI
errQi Zheng; Boyang Li; Sizhan Liu; Chuntian Cao; Jessica M. Rimsza; Qiubo Zhang; Jianming Bai; Chun Chang; Jiawei Wang; Chengyao Liang; Haiyan Mao; Matthew R. Carbone; Deyu Lu; Tatiana Pyatina; Haimei Zheng
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Resolving local structural motifs across the phase evolution of zinc titanates with computational x-ray absorption spectroscopy
err2025-02-21
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PREAI
errJiang, Xuance; Li, Ruoshui; Stacchiola, Dario J.; Stavitski, Eli; Qu, Xiaohui; Hybertsen, Mark S.; Liu, Mingzhao; Lu, Deyu
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Elucidating the Discharge Behavior of Aqueous Zinc Sulfur Batteries in the Presence of Molybdenum(IV) Chalcogenide Catalyst: The Criticality of Interfacial Electrochemistry
err2024-11-22
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PREAI
errWang, Zhongling; Kuang, Jason; Rodriguez-Campos, Armando; Cao, Chuntian; Kingan, Arun; Barry, Patrick J.; Hill, Ryan C.; Arnot, David J.; Christianne, Adora; Bock, David C.; Du, Yonghua; Bak, Seong Min; Ma, Lu; Yang, Dali; Tayal, Akhil; Drakopoulos, Michael; Zhong, Zhong; Vo, Nghia T.; Kisslinger, Kim; Tong, Xiao; Takeuchi, Esther S.; Carbone, Matthew R.; Lu, Deyu; Wang, Lei; Yan, Shan; Takeuchi, Kenneth J.; Marschilok, Amy C.
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Spectroscopy-guided discovery of three-dimensional structures of disordered materials with diffusion models
err2024-11-11
err1
errOAAI
errKwon, Hyuna; Hsu, Tim; Sun, Wenyu; Jeong, Wonseok; Aydin, Fikret; Chapman, James; Chen, Xiao; Lordi, Vincenzo; Carbone, Matthew R.; Lu, Deyu; Zhou, Fei; Pham, Tuan Anh
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Enhancing Chiroptoelectronic Activity in Chiral 2D Perovskites via Chiral-Achiral Cation Mixing
err2024-10-10
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errOAAI
errLi, Hao; Sarker, Pranab; Zhang, Xiaoyu; Terban, Maxwell W.; Ghose, Sanjit; Dursun, Ibrahim; Cotlet, Mircea; Li, Mingxing; Zhang, Yugang; Xu, Yuanze; Ramakrishnan, Shripathi; Wei, Tao; Lu, Deyu; Yu, Qiuming
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In situ Synchrotron X-ray Metrology Boosted by Automated Data Analysis for Real-time Monitoring of Cathode Calcination
err2024-09-09
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errOAAI
errDongol, Ruhil; Mukherjee, Arpan; Bai, Jianming; van Dam, Hubertus J. J.; Carbone, Matthew R.; Abell, E. Frits; Zhong, Hui; Tayal, Akhil; Ma, Lu; Kahvecioglu, Ozgenur; Pupek, Krzysztof Z.; Lu, Deyu; Rajan, Krishna; Wang, Feng
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Atomic insights into the oxidative degradation mechanisms of sulfide solid electrolytes
err2024-04-01
err1
errOAAI
errCao, Chuntian; Carbone, Matthew R.; Komurcuoglu, Cem; Shekhawat, Jagriti S.; Sun, Kerry; Guo, Haoyue; Liu, Sizhan; Chen, Ke; Bak, Seong-Min; Du, Yonghua; Weiland, Conan; Tong, Xiao; Steingart, Daniel A.; Yoo, Shinjae; Artrith, Nongnuch; Urban, Alexander; Lu, Deyu; Wang, Feng
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Multicode benchmark on simulated Ti K-edge x-ray absorption spectra of Ti-O compounds
err2024-01-11
err7
errOAAI
errMeng, Fanchen; Maurer, Benedikt; Peschel, Fabian; Selcuk, Sencer; Hybertsen, Mark; Qu, Xiaohui; Vorwerk, Christian; Draxl, Claudia; Vinson, John; Lu, Deyu
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Harnessing Neural Networks for Elucidating X-ray Absorption Structure-Spectrum Relationships in Amorphous Carbon
err2023-08-15
err10
errOAAI
errKwon, Hyuna; Sun, Wenyu; Hsu, Tim; Jeong, Wonseok; Aydin, Fikret; Sharma, Shubham; Meng, Fanchen; Carbone, Matthew R.; Chen, Xiao; Lu, Deyu; Wan, Liwen F.; Nielsen, Michael H.; Pham, Tuan Anh
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Temperature-Dependent Optical and Structural Properties of Chiral Two-Dimensional Hybrid Lead-Iodide Perovskites
err2023-08-02
err5
PREAI
errDursun, Ibrahim; Terban, Maxwell W.; Xu, Yuanze; Zhang, Xiaoyu; Ghose, Sanjit; Li, Mingxing; Sarker, Pranab; Li, Hao; Cotlet, Mircea; Wei, Tao; Lu, Deyu; Yu, Qiuming
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Dirac nodal arc in 1T-VSe2
err2023-06-23
err4
errOAAI
errYilmaz, Turgut; Jiang, Xuance; Lu, Deyu; Sheverdyaeva, Polina M.; Matetskiy, Andrey V.; Moras, Paolo; Mazzola, Federico; Vobornik, Ivana; Fujii, Jun; Evans-Lutterodt, Kenneth; Vescovo, Elio
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Simulated sulfur K-edge X-ray absorption spectroscopy database of lithium thiophosphate solid electrolytes
err2023-06-02
err7
errOAAI
errGuo, Haoyue; Carbone, Matthew R.; Cao, Chuntian; Qu, Jianzhou; Du, Yonghua; Bak, Seong-Min; Weiland, Conan; Wang, Feng; Yoo, Shinjae; Artrith, Nongnuch; Urban, Alexander; Lu, Deyu
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Decoding structure-spectrum relationships with physically organized latent spaces
err2023-05-16
err5
errOAAI
errLiang, Zhu; Carbone, Matthew R.; Chen, Wei; Meng, Fanchen; Stavitski, Eli; Lu, Deyu; Hybertsen, Mark S.; Qu, Xiaohui
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Uncertainty-aware predictions of molecular x-ray absorption spectra using neural network ensembles
err2023-03-15
err14
errOAAI
errGhose, Animesh; Segal, Mikhail; Meng, Fanchen; Liang, Zhu; Hybertsen, Mark S.; Qu, Xiaohui; Stavitski, Eli; Yoo, Shinjae; Lu, Deyu; Carbone, Matthew R.
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