汪海迪｜合肥工业大学｜学者主页

2026

Programmable 2D Magnetic Clusterphenes With High Curie Temperature and Strong Magnetic Anisotropy via Cluster Assembly and Ligand Synergy

Junxiang Fu, Zhuohang Fang, Haidi Wang, Yi Yang, Weiduo Zhu, W P Chen, Yu Zhang, Hai-Xiao Xiao, Zhao Chen, Hongyan Lv, X J Liu, Xiangyang Li, Xiao Cheng Zeng, Zhongjun Li

Advanced Functional Materials

DOI

2026

Unlocking cooperative Schottky barrier modulation via weakening Fermi-level pinning in composite–metal–MoS2 heterostructures

Yonglong Bai, Yahui Zheng, Zhuohang Fang, Weiduo Zhu, Ye Yang, Wei-Wei Chen, Qiong Tang, Junfeng Wang, Xiao-Feng Liu, Zhao Chen, Haixiao Xiao, Haidi Wang, Zhong-Jun Li

Applied Physics Letters

DOI

2026

High-throughput screening of two-dimensional ferromagnetic materials with high Curie temperatures.

Shuo Li, Chao Jia, Haidi Wang, Xingxing Li, Qun-Xiang Li

Nanoscale

DOI

2026

Machine-learning-assisted discovery of a stable Li3As2 intermediate phase in the Li-As binary system and its electrochemical implications.

Shuai-Shuai Ge, Weiduo Zhu, Haidi Wang

Physical Chemistry, Chemical Physics - PCCP

DOI

2026

High-throughput screening of two-dimensional multifunctional Janus M2X2via machine learning force fields.

Haidi Wang, Haonan Song, Weiduo Zhu, Wei-Wei Chen, Zhong-Jun Li, Zhao Chen, Xiao-Feng Liu

Physical Chemistry, Chemical Physics - PCCP

DOI

2025

High-Throughput Calculations of Two-Dimensional Auxetic M4X8 (M = Transition Metals, X = Halogens) with Magnetism, Electrocatalysis, and Alkali Metal Battery Applications

Haidi Wang, Wei Lan Lin, Weiduo Zhu, Zhao Chen, Zhongjun Li, Xiaofeng Liu

ACS Applied Materials & Interfaces

DOI

2025

High-throughput screening of ferrimagnetic semiconductors with ultrahigh Néel temperature

Haidi Wang, Qingqing Feng, Shuo Li, Wei Lan Lin, Weiduo Zhu, Zhao Chen, Zhongjun Li, Xiaofeng Liu, Xingxing Li

Physical Review Materials

DOI

2025

Atomic-Scale Origins and Shielding-Corrected Dipole Predictions of Surface Electrostatic Potential Difference in Metal–TMDC Contacts

Xiao Jia Tang, Yahui Zheng, Haidi Wang, Weiduo Zhu, Zhao Chen, Qiong Tang, Hongyan Lv, Xiaofeng Liu, Wei Hu, Zhongjun Li, Jinlong Yang

The Journal of Physical Chemistry Letters

DOI

2024

Molecule‐Induced Huge d‐p Overlap Enhances Superexchange Interaction for Room‐Temperature In‐Plane Magnetism and Giant Magneto Band‐Structure Effect in Ferromagnetic Clusterphene

Xiaofeng Liu, Y. H. Bai, Weiduo Zhu, Zhao Liu, Zhao Chen, Pengfei Gao, Haidi Wang, Zhongjun Li, Bing Wang, Xingxing Li, Wei Hu, Jinlong Yang

Advanced Functional Materials

DOI

2024

Two-dimensional multifunctional metal–organic frameworks with large in-plane negative Poisson ratios and photocatalytic water splitting properties

Lin Wei, Huimiao Wang, Huimiao Wang, Yaling Luo, Xiaofeng Liu, Zhongjun Li, Weiduo Zhu, Xingxing Li, Zhao Chen, Haidi Wang, Haidi Wang

Materials Horizons

DOI

2024

Phonon-induced nonadiabatic and adiabatic mechanisms synergistically driving ultrafast interlayer transfer of photogenerated charges in heterostructures of g − C 3 N 4 with MoT e 2 and WT e 2

Weibo Li, Xiao Jia Tang, Yahui Zheng, Haidi Wang, Zhao Chen, Weiduo Zhu, Hongyan Lv, Chunhua Wang, Xiaofeng Liu, Hai-Xiao Xiao, Xiao Cheng Zeng, Zhongjun Li

Physical review. B./Physical review. B

DOI

2023

Large tunneling magnetoresistance in spin-filtering 1T-MnSe 2 /h-BN van der Waals magnetic tunnel junction

Zhao Chen, Xiaofeng Liu, Xingxing Li, Xingxing Li, Pengfei Gao, Zhongjun Li, Weiduo Zhu, Haidi Wang, Xiangyang Li, Xiangyang Li

Nanoscale

DOI

2023

High out-of-plane negative Poisson's ratios and strong light harvesting in two-dimensional SiS 2 and its derivatives

Haidi Wang, Tao Li, Zhao Chen, Weiduo Zhu, Wei C. Lin, Huimiao Wang, Xiaofeng Liu, Zhongjun Li

Nanoscale

DOI

2023

Enhanced Direct Exchange Interaction and Hybridization by Single-Atom Linkers for High Curie Temperature and Superior Visible-Light Harvesting in Cr3(CN3)2.

Xiao-Feng Liu, Haidi Wang, Zhao Chen, Weiduo Zhu, Zhong-Jun Li, Wei Hu, Haixiao Xiao, Xiao-Cheng Zeng

Nano letters (Print)

DOI

2023

mech2d: An Efficient Tool for High-Throughput Calculation of Mechanical Properties for Two-Dimensional Materials

Haidi Wang, Tao Li, Xiao-Feng Liu, Weiduo Zhu, Zhao Chen, Zhong-Jun Li, Jin-Long Yang

Molecules

DOI

2023

Enhanced electron–phonon coupling by delocalizing phonon states for desirable interlayer transfer of excited charges in MoSSe/WS2 heterobilayer

Yahui Zheng, Hong-Liang Zhao, Weibo Li, Zhao Chen, Weiduo Zhu, Xiao-Feng Liu, Qiong Tang, Haidi Wang, Chunhua Wang, Zhong-Jun Li

Applied Physics Letters

DOI

2023

Resolving Interface Barrier Deviation from the Schottky-Mott Rule: A Mitigation Strategy via Engineering MoS2-Metal van der Waals Contact.

Zhong-Jun Li, Yahui Zheng, Guojun Li, Han-Xi Wang, Weiduo Zhu, Haidi Wang, Zhao Chen, Yupeng Yuan, Xiao-Cheng Zeng, Yucheng Wu

Journal of Physical Chemistry Letters

DOI

2022

Structural and electrocatalytic properties of copper clusters: A study via deep learning and first principles

Xiaoning Wang, Haidi Wang, Qiquan Luo, Jinlong Yang

The Journal of Chemical Physics

DOI

2022

Penta-CN2 revisited: Superior stability, synthesis condition exploration, negative Poisson’s ratio and quasi-flat bands

Haidi Wang, Zhao Chen, Zhaotong Liu

Applications of Surface Science

DOI

2021

High-Throughput Computational Screening for Bipolar Magnetic Semiconductors

Haidi Wang, Q. Feng, Xing-Xing Li, Jin-Long Yang

Research

DOI

2021

Substantial and stable magnetoresistance and spin conductance in phosphorene-based spintronic devices with Co electrodes

Zhao Chen, Guojun Li, Haidi Wang, Qiong Tang, Zhongjun Li

Physical Chemistry Chemical Physics

DOI

2021

Crystallization of the P3Sn4 Phase upon Cooling P2Sn5 Liquid by Molecular Dynamics Simulation Using a Machine Learning Interatomic Potential

Chao Zhang, Yang Sun, Haidi Wang, Feng Zhang, Tong-Qi Wen, K. Ho, Cai-Zhuang Wang

DOI

2021

Two-Dimensional Auxetic GeSe2 Material with Ferroelasticity and Flexoelectricity

Zhao Chen, Zhong-Jun Li, Haidi Wang

Journal of Physical Chemistry C

DOI

2020

First-principles study of two dimensional C 3 N and its derivatives

Zhao Chen, Haidi Wang, Zhongjun Li

RSC Advances

DOI

2019

Development of a deep machine learning interatomic potential for metalloid-containing Pd-Si compounds

Tong-Qi Wen, Cai-Zhuang Wang, M. Kramer, Yang Sun, Beilin Ye, Haidi Wang, Xue-Yong Liu, Chao Zhang, Feng Zhang, K. Ho, Nan Wang

Physical review B

DOI

2018

Penta-Pt2N4: an ideal two-dimensional material for nanoelectronics.

Zhao Liu, Haidi Wang, Jiuyu Sun, Ru-Jie Sun, Z.-F. Wang, Jin-Long Yang

Nanoscale

DOI

2017

低维材料的电—力学性质和晶体结构的理论计算研究

汪海迪

《中国科学技术大学》

2017

BP5 monolayer with multiferroicity and negative Poisson’s ratio: a prediction by global optimization method

Haidi Wang, Xing-Xing Li, Jiuyu Sun, Zhao Liu, Jin-Long Yang

DOI

2017

ψ-Phosphorene: a new allotrope of phosphorene.

Haidi Wang, Xing-Xing Li, Zhao Liu, Jin-Long Yang

Physical Chemistry, Chemical Physics - PCCP

DOI

2017

Electronic, Optical, and Mechanical Properties of Diamond Nanowires Encapsulated in Carbon Nanotubes: A First-Principles View

Haidi Wang, Bin Li, Jin-Long Yang

DOI

2017

ψ‐ホスホレンホスホレンの新しい同素体

Haidi Wang, Xing-Xing Li, Zhao Liu, Jin-Long Yang

2017

δホスホレン:高度に負のポアソン比を有する2次元材料【Powered by NICT】

Haidi Wang, Xing-Xing Li, Pai Li, Jin-Long Yang

2016

δ-Phosphorene: a two dimensional material with a highly negative Poisson's ratio.

Haidi Wang, Xing-Xing Li, Pai Li, Jin-Long Yang

Nanoscale

DOI

精选作品

期刊论文

Programmable 2D Magnetic Clusterphenes With High Curie Temperature and Strong Magnetic Anisotropy via Cluster Assembly and Ligand Synergy

Unlocking cooperative Schottky barrier modulation via weakening Fermi-level pinning in composite–metal–MoS2 heterostructures

High-throughput screening of two-dimensional ferromagnetic materials with high Curie temperatures.

Machine-learning-assisted discovery of a stable Li3As2 intermediate phase in the Li-As binary system and its electrochemical implications.

High-throughput screening of two-dimensional multifunctional Janus M2X2via machine learning force fields.

High-Throughput Calculations of Two-Dimensional Auxetic M4X8 (M = Transition Metals, X = Halogens) with Magnetism, Electrocatalysis, and Alkali Metal Battery Applications

High-throughput screening of ferrimagnetic semiconductors with ultrahigh Néel temperature

Atomic-Scale Origins and Shielding-Corrected Dipole Predictions of Surface Electrostatic Potential Difference in Metal–TMDC Contacts

Molecule‐Induced Huge d‐p Overlap Enhances Superexchange Interaction for Room‐Temperature In‐Plane Magnetism and Giant Magneto Band‐Structure Effect in Ferromagnetic Clusterphene

Two-dimensional multifunctional metal–organic frameworks with large in-plane negative Poisson ratios and photocatalytic water splitting properties

Phonon-induced nonadiabatic and adiabatic mechanisms synergistically driving ultrafast interlayer transfer of photogenerated charges in heterostructures of g − C 3 N 4 with MoT e 2 and WT e 2

Large tunneling magnetoresistance in spin-filtering 1T-MnSe 2 /h-BN van der Waals magnetic tunnel junction

High out-of-plane negative Poisson's ratios and strong light harvesting in two-dimensional SiS 2 and its derivatives

Enhanced Direct Exchange Interaction and Hybridization by Single-Atom Linkers for High Curie Temperature and Superior Visible-Light Harvesting in Cr3(CN3)2.

mech2d: An Efficient Tool for High-Throughput Calculation of Mechanical Properties for Two-Dimensional Materials

Enhanced electron–phonon coupling by delocalizing phonon states for desirable interlayer transfer of excited charges in MoSSe/WS2 heterobilayer

Resolving Interface Barrier Deviation from the Schottky-Mott Rule: A Mitigation Strategy via Engineering MoS2-Metal van der Waals Contact.

Structural and electrocatalytic properties of copper clusters: A study via deep learning and first principles

Penta-CN2 revisited: Superior stability, synthesis condition exploration, negative Poisson’s ratio and quasi-flat bands

High-Throughput Computational Screening for Bipolar Magnetic Semiconductors

Substantial and stable magnetoresistance and spin conductance in phosphorene-based spintronic devices with Co electrodes

Crystallization of the P3Sn4 Phase upon Cooling P2Sn5 Liquid by Molecular Dynamics Simulation Using a Machine Learning Interatomic Potential

Two-Dimensional Auxetic GeSe2 Material with Ferroelasticity and Flexoelectricity

First-principles study of two dimensional C 3 N and its derivatives

Development of a deep machine learning interatomic potential for metalloid-containing Pd-Si compounds

Penta-Pt2N4: an ideal two-dimensional material for nanoelectronics.

低维材料的电—力学性质和晶体结构的理论计算研究

BP5 monolayer with multiferroicity and negative Poisson’s ratio: a prediction by global optimization method

ψ-Phosphorene: a new allotrope of phosphorene.

Electronic, Optical, and Mechanical Properties of Diamond Nanowires Encapsulated in Carbon Nanotubes: A First-Principles View

ψ‐ホスホレン ホスホレンの新しい同素体

δホスホレン:高度に負のポアソン比を有する2次元材料【Powered by NICT】

δ-Phosphorene: a two dimensional material with a highly negative Poisson's ratio.

会议论文

δ-磷:一种新奇的负泊松比材料

预印本

UniMatSim: A High-Throughput Materials Simulation Automation Framework Based on Universal Machine Learning Potentials

Uni2D: A Universal Machine Learning Interatomic Potential for Two-Dimensional Materials

Benchmarking Universal Machine Learning Interatomic Potentials for Elastic Property Prediction

DP-GEN: A concurrent learning platform for the generation of reliable deep learning based potential energy models

C3N: a Two Dimensional Semiconductor Material with High stiffness,Superior Stability and Bending Poisson's Effect

研究方向

ψ‐ホスホレンホスホレンの新しい同素体