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physics.chem-phcond-mat.mtrl-sciphysics.comp-phcond-mat.str-elcond-mat.dis-nncond-mat.mes-hallcond-mat.supr-conquant-phallotropycond-mat.other

On Valency

published · living versions

Preprints & journals

113 papers in the corpus · 2012–2026
Empowering neural network-based quantum Monte Carlo with local pseudopotentials.42432321 · Fu, Weizhong, Fujimaru, Ryunosuke, Li, Ruichen et al.2026 · 1 citationNature computational science. 2026;6(9):1005-1014
Dataset distillation for machine learning force field in phase transition regime.42334160 · Chen, Ruiyang, Zhang, Qingyuan, Chen, Ji2026 · 0 citationsThe Journal of chemical physics. 2026;164(24)
A Unified Generative Framework for Scalable Chemical Reaction Network Exploration2606.21002v1 · Zechang Sun, Chenxi Hu, Kailai Lin et al.2026 · 0 citationsarXiv
Topological invariant of periodic many body wavefunction from charge pumping simulation2604.08702v1 · Haoxiang Chen, Yubing Qian, Weiluo Ren et al.2026 · 0 citationsarXiv
Permutation invariant multi-scale full quantum neural network wavefunction2603.12233v1 · Pengzhen Cai, Yubing Qian, Li Deng et al.2026 · 0 citationsarXiv
Integral Variable Range Hopping for Modeling Electrical Transport in Disordered Systems2601.10226v1 · Chenxin Qin, Chenyan Wang, Mouyang Cheng et al.2026 · 0 citationsarXiv
Stochastic representation of time-evolving neural network-based wavefunctions.41439731 · Huang, Bizi, Fu, Weizhong, Chen, Ji2025 · 1 citationThe Journal of chemical physics. 2025;163(24)
Down to one network for computing crystalline materials.41125911 · Qian, Yubing, Chen, Ji2025 · 0 citationsNature computational science. 2025;5(12):1098-1099
Author Correction: The first-principles phase diagram of monolayer nanoconfined water.41331353 · Kapil, Venkat, Schran, Christoph, Zen, Andrea et al.2026 · 1 citationNature. 2025;648(8094):E15
Deep-learning electronic structure calculations.41430378 · Tang, Zechen, Chen, Haoxiang, Li, Yang et al.2025 · 12 citationsNature computational science. 2025;5(12):1133-1146
A multi-resolution systematically improvable quantum embedding scheme for large-scale surface chemistry calculations.41120360 · Huang, Zigeng, Guo, Zhen, Cao, Changsu et al.2025 · 7 citationsNature communications. 2025;16(1):9297
Eliminating Defect States in Monolayer Tungsten Diselenide by Coupling with a c-Plane Sapphire Surface.41046401 · Huang, Chen, Wang, Jinhuan, Chen, Yilin et al.2025 · 5 citationsPhysical review letters. 2025;135(12):126201
Individual and Cooperative Superexchange Enhancement in Cuprates.40960817 · Jiang, Tonghuan, Bogdanov, Nikolay A, Alavi, Ali et al.2025 · 0 citationsJournal of chemical theory and computation. 2025;21(19):9364-9375
A particle view of many-body electronic structure with neural network wavefunction2508.13751v1 · Zichen Wang, Weizhong Fu, Zhe Li et al.2025 · 0 citationsarXiv
Quantum Many-Body Simulations of Catalytic Metal Surfaces2508.13036v3 · Changsu Cao, Hung Q. Pham, Zhen Guo et al.2025 · 0 citationsarXiv
Molecularly resolved mapping of heterogeneous ice nucleation and crystallization pathways using in-situ cryo-TEM.40783494 · Wang, Zibing, Yuan, Zifeng, Cheng, Mouyang et al.2025 · 8 citationsNature communications. 2025;16(1):7349
Simulated Atomistic Growth of Amorphous Monolayer Carbon.40569109 · Hu, Jiani, Cheng, Mouyang, Han, Erxun et al.2025 · 3 citationsThe journal of physical chemistry letters. 2025;16(27):6866-6873
Nuclear quantum effects in two-hydrogen intermediates on graphene-embedded transition metal atoms.40459272 · Han, Erxun, Fang, Wei, Chen, Ji2025 · 2 citationsPhysical chemistry chemical physics : PCCP. 2025;27(23):12542-12549
Publisher Correction: Imaging surface structure and premelting of ice Ih with atomic resolution.40404943 · Hong, Jiani, Tian, Ye, Liang, Tiancheng et al.2025 · 0 citationsNature. 2025;642(8067):E18
Describing Landau Level Mixing in Fractional Quantum Hall States with Deep Learning.40408749 · Qian, Yubing, Zhao, Tongzhou, Zhang, Jianxiao et al.2025 · 12 citationsPhysical review letters. 2025;134(17):176503
Deep Learning Sheds Light on Integer and Fractional Topological Insulators2503.11756v1 · Xiang Li, Yixiao Chen, Bohao Li et al.2025 · 1 citationarXiv
ByteQC: GPU-Accelerated Quantum Chemistry Package for Large-Scale Systems2502.17963v2 · Zhen Guo, Zigeng Huang, Qiaorui Chen et al.2025 · 7 citationsarXiv
Pressure-induced structural and superconducting transitions in black arsenic2502.01955v1 · Y. Y. Wu, L. Mu, Y. L. Zhang et al.2025 · 7 citationsarXiv
Advancing Surface Chemistry with Large-Scale Ab-Initio Quantum Many-Body Simulations2412.18553v2 · Zigeng Huang, Zhen Guo, Changsu Cao et al.2024 · 2 citationsarXiv
Commensurate to Incommensurate Transition of Three Dimensional Charge Density Waves2412.06459v1 · Hao Wang, Qiang Luo, Ji Chen2024 · 0 citationsPhys.Rev.B 111 (2025) L161112
Spin-symmetry-enforced solution of the many-body Schrödinger equation with a deep neural network.39633095 · Li, Zhe, Lu, Zixiang, Li, Ruichen et al.2024 · 17 citationsNature computational science. 2024;4(12):910-919
Probing quantum critical phase from neural network wavefunction2411.19938v1 · Haoxiang Chen, Weiluo Ren, Xiang Li et al.2024 · 0 citationsarXiv
Ultracompact Electrical Double Layers at TiO2(110) Electrified Interfaces.39586092 · Nadeem, Immad M, Penschke, Christopher, Chen, Ji et al.2026 · 5 citationsJournal of the American Chemical Society. 2024;146(49):33443-33451
Force and stress calculations with a neural-network wave function for solids.39058255 · Qian, Yubing, Li, Xiang, Chen, Ji2024 · 5 citationsFaraday discussions. 2024;254(0):529-541
Stochastic and low-scaling techniques/extended systems: general discussion.39399904 · Alavi, Ali, Atalar, Kemal, Berkelbach, Timothy C et al.2026 · 0 citationsFaraday discussions. 2024;254(0):570-585
Unveiling sulfur vacancy pairs as bright and stable color centers in monolayer WS2.39488514 · Sun, Huacong, Yang, Qing, Wang, Jianlin et al.2024 · 36 citationsNature communications. 2024;15(1):9476
Predicting macroscopic properties of amorphous monolayer carbon via pair correlation function2410.03116v1 · Mouyang Cheng, Chenyan Wang, Chenxin Qin et al.2024 · 10 citationsarXiv
In Situ Closing the van der Waals Gap of Two-Dimensional Materials.39352696 · Wu, Shengqiang, Li, Siheng, Meng, Yuan et al.2024 · 2 citationsJournal of the American Chemical Society. 2024
Deep learning quantum Monte Carlo for solids2407.00707v1 · Yubing Qian, Xiang Li, Zhe Li et al.2024 · 7 citationsarXiv
Emergent Wigner phases in moiré superlattice from deep learning2406.11134v1 · Xiang Li, Yubing Qian, Weiluo Ren et al.2024 · 6 citationsarXiv
Degree of disorder-regulated ion transport through amorphous monolayer carbon.38808236 · Liu, Shizhuo, Cao, Ran, Hu, Jiani et al.2024 · 9 citationsRSC advances. 2024;14(24):17032-17040
Imaging surface structure and premelting of ice Ih with atomic resolution.38778112 · Hong, Jiani, Tian, Ye, Liang, Tiancheng et al.2024 · 79 citationsNature. 2024;630(8016):375-380
Electric Polarization from a Many-Body Neural Network Ansatz.38728714 · Li, Xiang, Qian, Yubing, Chen, Ji2024 · 9 citationsPhysical review letters. 2024;132(17):176401
Atomic-scale observation of localized phonons at FeSe/SrTiO3 interface.38653990 · Shi, Ruochen, Li, Qize, Xu, Xiaofeng et al.2024 · 31 citationsNature communications. 2024;15(1):3418
Understanding the wetting of transition metal dichalcogenides from an ab initio perspective2402.11470v1 · Siheng Li, Keyang Liu, Jir'i Klimes et al.2024 · 8 citationsarXiv
Nanoscale one-dimensional close packing of interfacial alkali ions driven by water-mediated attraction.38049594 · Tian, Ye, Song, Yizhi, Xia, Yijie et al.2026 · 44 citationsNature nanotechnology. 2024;19(4):479-484
Origin of dielectric polarization suppression in confined water from first principles.38179530 · Dufils, T, Schran, C, Chen, J et al.2024 · 58 citationsChemical science. 2024;15(2):516-527
Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces from machine learning molecular dynamics simulations.37783698 · Zeng, Zezhu, Wodaczek, Felix, Liu, Keyang et al.2023 · 81 citationsNature communications. 2023;14(1):6131
Career total: 177 works. 113 are in this corpus.Showing the 50 most recent.

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