1.?Wu, Qingchen; Kang, Lei*; Lin, Zheshuai*, A Machine Learning Study on High Thermal Conductivity Assisted to Discover Chalcogenides with Balanced Infrared Nonlinear Optical Performance, Adv. Mater. 2024, 36, 2309675. DOI: 10.1002/adma.202309675.
2.?Zhang, Xingyu; Liu, Youquan; Molokeev, Maxim S.; Xu, Bohui; Jiang, Xingxing*; Lin, Zheshuai*, Realizing Persistent Zero Area Compressibility over a Wide Pressure Range in Cu2GeO4 by Microscopic Orthogonal-Braiding Strategy, Angew. Chem. Int. Ed. 2024, e202318401. DOI: 10.1002/anie.202318401.
3.?Linfeng Dong, Shengzi Zhang, Pifu Gong*, Lei Kang*, Zheshuai Lin*, Evaluation and prospect of Mid-Infrared nonlinear optical materials in f0 rare earth (RE = Sc, Y, La) chalcogenides, Coord. Chem. Rev. 2024, 509, 215805. DOI: 10.1016/j.ccr.2024.215805.
4.?Jiang, Xingxing; Zhang, Shengzi; Jiang, Dequan; Wang, Yonggang; Molokeev, Maxim S.; Wang, Naizheng; Liu, Youquan; Zhang, Xingyu; Lin, Zheshuai*,?Unexpected giant negative area compressibility in palladium diselenide, National Sci. Rev. 2023, 10,　nwad016. DOI: 10.1093/nsr/nwad016.
5.?Jiang, Xingxing; Molokeev, Maxim S.; Wang, Naizheng; Wang, Yonggang*; Wen, Ting; Dong, Zhichao; Liu, Youquan; Li, Wei*; Lin, Zheshuai*, sp2 to sp3 Hybridization Transformation in Ionic Crystals under Unprecedentedly Low Pressure, Angew. Chem. Int. Ed. 2022, 61, e202208247. DOI: 10.1002/anie.202208247.
6.?Kang, Lei; Lin, Zheshuai*, Deep-ultraviolet nonlinear optical crystals: concept development and materials discovery, Light: Sci. & Appl. 2022, 11, 201. DOI: 10.1038/s41377-022-00899-1.
7.?Kang, Lei; Gong, Pifu; Lin, Zheshuai*; Huang, Bing*, Deep-Ultraviolet Nonlinear-Optical van-der-Waals Beryllium Borates, Angew. Chem. Int. Ed. 2021, 60, 16680-16686. DOI: 10.1002/anie.202105789.
8.?Liu, Xiaomeng; Kang, Lei; Gong, Pifu*; Lin, Zheshuai*, LiZn(OH)CO3: A Deep-Ultraviolet Nonlinear Optical Hydroxycarbonate Designed from a Diamond-like Structure, Angew. Chem. Int. Ed. 2021, 60, 13574-13578. DOI: 10.1002/anie.202101308.
9.?Kang, Lei; Liang, Fei; Jiang, Xingxing; Lin, Zheshuai*; Chen, Chuangtian, First-Principles Design and Simulations Promote the Development of Nonlinear Optical Crystals, Acc. Chem. Res. 2020, 53, 209-217. DOI: 10.1021/acs.accounts.9b00448.
10.?Chi, Shumeng; Liang, Fei; Chen, Hongxiang; Tian, Wendong; Zhang, Han; Yu, Haohai*; Wang, Gang*; Lin, Zheshuai*; Hu, Jiangping; Zhang, Huaijin*, Surface Nonlinear Optics on Centrosymmetric Dirac Nodal-Line Semimetal ZrSiS, Adv. Mater. 2020,?32, 1904498. DOI: 10.1002/adma.201904498.
11.?Gong, Pifu; Kang, Lei*; Lin, Zheshuai*, Realizing Deep-Ultraviolet Second Harmonic Generation by First-Principles-Guided Materials Exploration in Hydroxyborates, J. Am. Chem. Soc. 2020, 142, 15157-15163. DOI: 10.1021/jacs.0c07256.
12.?Lin, Kun; Gong, Pifu; Chu, Shihang; Li, Qiang; Lin, Zheshuai*; Wu, Hui; Wang, Qingxiao; Wang, Jinguo; Kim, Moon J.; Kato, Kenichi; Wang, Chin-Wei; Liu, Xinzhi; Huang, Qingzhen; Chen, Jun; Zhu, He; Deng, Jinxia; Xing, Xianran*, Strong Second Harmonic Generation in a Tungsten Bronze Oxide by Enhancing Local Structural Distortion, J. Am. Chem. Soc. 2020, 142, 7480-7486. DOI: 10.1021/jacs.0c00133.
13.?Jiang, Xingxing; Molokeev, Maxim S.; Dong, Liyuan; Dong, Zhichao; Wang, Naizheng; Kang, Lei; Li, Xiaodong; Li, Yanchun; Tian, Chuan; Peng, Shiliu; Li, Wei; Lin, Zheshuai*, Anomalous mechanical materials squeezing three-dimensional volume compressibility into one dimension, Nat. Comm. 2020, 11, 5593. DOI: 10.1038/s41467-020-19219-5
14.?Zhang, Xinyuan; Kang, Lei*; Gong, Pifu; Lin, Zheshuai*; Wu, Yicheng, Nonlinear Optical Oxythiophosphate Approaching the Good Balance with Wide Ultraviolet Transparency, Strong Second Harmonic Effect, and Large Birefringence, Angew. Chem. Int. Ed. 2020, 60, 6386-6390. DOI: 10.1002/anie.202016013.
15.?Zhou, Jinjie; Liu, Youquan; Wu, Hongping; Yu, Hongwei*; Lin, Zheshuai*; Hu, Zhanggui*; Wang, Jiyang; Wu, Yicheng, CsZn2BO3X2(X2=F2, Cl2, and FCl): A Series of Beryllium-Free Deep-Ultraviolet Nonlinear-Optical Crystals with Excellent Properties, Angew. Chem. Int. Ed. 2020, 59, 19006-19010. DOI: 10.1002/anie.202008346.
16.?Liu, Shuai; Liu, Xiaomeng; Zhao, Sangen*; Liu, Youchao; Li, Lina; Ding, Qingran; Li, Yanqiang; Lin, Zheshuai*; Luo, Junhua; Hong, Maochun, An Exceptional Peroxide Birefringent Material Resulting from d-π Interactions, Angew. Chem. Int. Ed. 2020, 59, 9414-9417. DOI: 10.1002/anie.202002828.
17.?Song, Gaomin; Li, Mingze; Zhang, Shengzi; Wang, Naizheng; Gong, Pifu*; Xia, Zhiguo*; Lin, Zheshuai*, Enhancing Photoluminescence Quantum Yield in 0D Metal Halides by Introducing Water Molecules, Adv. Funct. Mater. 2020, 30, 2002468. DOI: 10.1002/adfm.202002468.
18.?Wei, Wen-Juan; Jiang, Xing-Xing; Dong, Li-Yuan; Liu, Wei-Wei; Han, Xiao-Bo; Qin, Yan; Li, Kai; Li, Wei*; Lin, Zheshuai*; Bu, Xian-He*; Lu, Pei-Xiang*, Regulating Second-Harmonic Generation by van der Waals Interactions in Two-dimensional Lead Halide Perovskite Nanosheets, J. Am. Chem. Soc. 2019, 141, 9134-9139. DOI: 10.1021/jacs.9b01874.
19.?Li, Yanqiang; Liang, Fei; Zhao, Sangen*; Li, Lina; Wu, Zhenyue; Ding, Qingran; Liu, Shuai; Lin, Zheshuai*; Hong, Maochun; Luo, Junhua*, Two Non-?-Conjugated Deep-UV Nonlinear Optical Sulfates, J. Am. Chem. Soc. 2019, 141, 3833-3837. DOI: 10.1021/jacs.9b00138.
20.?You, Fengguang; Liang, Fei; Huang, Qian; Hu, Zhanggui*; Wu, Yicheng; Lin, Zheshuai*, Pb2GaF2(SeO3)2CI: Band Engineering Strategy by Aliovalent Substitution for Enlarging Bandgap while Keeping Strong Second Harmonic Generation Response, J. Am. Chem. Soc. 2019, 141, 748-752. DOI: 10.1021/jacs.8b11485.
21.?Liu, Xiaomeng; Gong, Pifu*; Yang, Yi; Song, Gaomin; Lin, Zheshuai*, Nitrate nonlinear optical crystals: A survey on structure-performance relationships, Coord. Chem. Rev. 2019, 400, 213045. DOI: 10.1016/j.ccr.2019.213045.
22.?Gong, Pifu; Liang, Fei; Kang, Lei; Chen, Xingguo*; Qin, Jingui; Wu, Yicheng; Lin, Zheshuai*?, Recent advances and future perspectives on infrared nonlinear optical metal halides, Coord. Chem. Rev. 2019, 380, 83, 102. DOI: 10.1016/j.ccr.2018.09.011.
23.?Xie, Ying; Liang, Fei; Wang, Dong; Chi, Shumeng; Yu, Haohai*; Lin, Zheshuai*; Zhang, Huaijin*; Chen, Yanxue; Wang, Jiyang; Wu, Yicheng, Room-Temperature Ultrabroadband Photodetection with MoS2 by Electronic-Structure Engineering Strategy, Adv. Mater. 2018, 30, 1804858, DOI: 10.1002/adma.201804858.
24.?Jiang, Xingxing; Yang, Yi; Molokeev, Maxim S.; Gong, Pifu; Liang, Fei; Wang, Shuaihua; Liu, Lei; Wu, Xiang; Li, Xiaodong; Li, Yanchun; Wu, Shaofan; Li, Wei; Wu, Yicheng; Lin, Zheshuai*, Zero Linear Compressibility in Nondense Borates with a Lu-Ban Stool-Like Structure, Adv. Mater. 2018, 30, 1801313. DOI: 10.1002/adma.201801313.
25.?Luo, Min; Liang, Fei; Song, Yunxia; Zhao, Dan; Ye, Ning*; Lin, Zheshuai*, Rational Design of the First Lead/Tin Fluorooxoborates MB2O3F2 (M = Pb, Sn), Containing Flexible Two-Dimensional [B6O12F6]∞ Single Layers with Widely Divergent Second Harmonic Generation Effects, J. Am. Chem. Soc. 2018, 140, 6814-6817. DOI: 10.1021/jacs.8b04333
26.?Lan, Haichao; Liang, Fei; Jiang, Xingxing; Zhang, Cong; Yu, Haohai*; Lin, Zheshuai*; Zhang, Huaijin*; Wang, Jiyang; Wu, Yicheng, Pushing Nonlinear Optical Oxides into the Mid-Infrared Spectral Region Beyond 10 pm: Design, Synthesis, and Characterization of La3SnGa5O14, J. Am. Chem. Soc. 2018, 140, 4684-4690. DOI: 10.1021/jacs.8b01009
27.?Zhao, Sangen*; Yang, Xiaoyan; Yang, Yi; Kuang, Xiaojun*; Lu, Fengqi; Shan, Pai; Sun, Zhihua; Lin, Zheshuai*; Hong, Maochun; Luo, Junhua*, Non-Centrosymmetric RbNaMgP2O7 with Unprecedented Thermo-Induced Enhancement of Second Harmonic Generation, J. Am. Chem. Soc. 2018, 140, 1592-1595. DOI: 10.1021/jacs.7b12518.
28.?Hou, Jungang*; Cao, Shuyan; Sun, Yiqing; Wu, Yunzhen; Liang, Fei; Lin, Zheshuai*; Sun, Licheng*, Atomically Thin Mesoporous In2O3-x/In2S3 Lateral Heterostructures Enabling Robust Broadband-Light Photo-Electrochemical Water Splitting, Adv. Energy Mater. 2018, 8, 1701114. DOI: 10.1002/aenm.201701114.
29.?Hou, Jungang*; Wu, Yunzhen; Cao, Shuyan; Liang, Fei; Lin, Zheshua*i; Gao, Zhanming; Sun, Licheng*, In Situ Phase-Induced Spatial Charge Separation in Core-Shell Oxynitride Nanocube Heterojunctions Realizing Robust Solar Water Splitting, Adv. Energy Mater. 2017, 7, 1700171. DOI: 10.1002/aenm.201700171.
30.?Liang, Fei; Kang, Lei; Lin, Zheshuai*; Wu, Yicheng; Chen, Chuangtian, Analysis and prediction of mid-IR nonlinear optical metal sulfides with diamond-like structures, Coord. Chem. Rev. 2017, 333, 57-70. DOI: 10.1016/j.ccr.2016.11.012.
31.?Hou, Jungang*; Cao, Shuyan; Wu, Yunzhen; Liang, Fei; Sun, Yongfu*; Lin, Zheshuai*; Sun, Licheng*, Simultaneously efficient light absorption and charge transport of phosphate and oxygen-vacancy confined in bismuth tungstate atomic layers triggering robust solar CO2 reduction, Nano Energy, 2017, 32, 359-366. DOI: 10.1016/j.nanoen.2016.12.054.
32.?Kang, Lei; Zhang, Xinyuan; Liang, Fei; Lin, Zheshuai*; Huang, Bing*, Poly(difluorophosphazene) as the First Deep-Ultraviolet Nonlinear Optical Polymer: A First-Principles Prediction, Angew. Chem. Int. Ed. 2019, 58, 10250-10254. DOI: 10.1002/anie.201905025.
33.?Liu, Hongming; Wu, Qi; Jiang, Xingxing; Lin, Zheshuai*; Meng, Xianggao; Chen, Xingguo*; Qin, Jingui, ABi2(IO3)2F5 (A = K, Rb, and Cs): ACombination of Halide and Oxide Anionic Units To Create a Large Second-Harmonic Generation Response with a Wide Bandgap, Angew. Chem. Int. Ed. 2017, 56, 9492-9496. DOI: 10.1002/anie.201705672.
34.?Zhao, Sangen; Yang, Yi; Shen, Yaoguo; Zhao, Bingqing; Li, Lina; Ji, Chengmin; Wu, Zhenyue; Yuan, Daqiang; Lin, Zheshuai*; Hong, Maochun; Luo, Junhua*, Cooperation of Three Chromophores Generates the Water-Resistant Nitrate Nonlinear Optical Material Bi3TeO6OH(NO3)2, Angew. Chem. Int. Ed. 2017, 56, 540-544. DOI: 10.1002/anie.201609876.
35.?Jiang, Xingxing; Molokeev, Maxim S.; Gong, Pifu; Yang, Yi; Wang, Wei; Wang, Shuaihua; Wu, Shaofan; Wang, Yingxia; Huang, Rongjin; Li, Laifeng; Wu, Yicheng; Xing, Xianran*; Lin, Zheshuai*, Near-Zero Thermal Expansion and High Ultraviolet Transparency in a Borate Crystal of Zn4B6O13, Adv. Mater. 2016, 28, 7936-7940. DOI: 10.1002/adma.201601816
36.?Xia, Mingjun; Jiang, Xingxing; Lin, Zheshuai*; Li, Rukang, All-Three-in-One: A New Bismuth-Tellurium-Borate Bi3TeBO9 Exhibiting Strong Second Harmonic Generation Response, J. Am. Chem. Soc. 2016, 138, 14190-14193. DOI: 10.1021/jacs.6b08813.
37.?Zhao, Sangen; Kang, Lei; Shen, Yaoguo; Wang, Xiaodong; Asghar, Muhammad Adnan; Lin, Zheshuai*; Xu, Yingying; Zeng, Siyuan; Hong, Maochun; Luo, Junhua*, Designing a Beryllium-Free Deep-Ultraviolet Nonlinear Optical Material without a Structural Instability Problem, J. Am. Chem. Soc. 2016, 138, 2961-2964. DOI: 10.1021/jacs.6b00436.
38.?Hou, Jungang*; Cao, Shuyan; Wu, Yunzhen; Liang, Fei; Ye, Lu; Lin, Zheshuai*; Sun, Licheng*,?Perovskite-based nanocubes with simultaneously improved visible-light absorption and charge separation enabling efficient photocatalytic CO2 reduction, Nano Energy, 2016, 30, 59-68. DOI: 10.1016/j.nanoen.2016.09.033.
39.?Jiang, Xingxing; Luo, Siyang; Kang, Lei; Gong, Pifu; Yao, Wenjiao; Huang, Hongwei; Li, Wei*; Huang, Rongjin; Wang, Wei; Li, Yanchun; Li, Xiaodong; Wu, Xiang; Lu, Peixiang; Li, Laifeng; Chen, Chuangtian; Lin, Zheshuai*, Isotropic Negative Area Compressibility over Large Pressure Range in Potassium Beryllium Fluoroborate and its Potential Applications in Deep Ultraviolet Region. Adv. Mater. 2015, 27, 4851-4857. DOI: 10.1002/adma.201502212.
40.?Kang, Lei; Zhou, Molin; Yao, Jiyong; Lin, Zheshuai*; Wu, Yicheng; Chen, Chuangtian, Metal Thiophosphates with Good Mid-infrared Nonlinear Optical Performances: A First-Principles Prediction and Analysis, J. Am. Chem. Soc. 2015, 137, 13049-13059. DOI: 10.1021/jacs.5b07920.
41.?Zhao, Sangen; Gong, Pifu; Luo, Siyang; Bai, Lei; Lin, Zheshuai*; Tang, Yuanyuan; Zhou, Yuelan; Hong, Maochun; Luo, Junhua*, Tailored Synthesis of a Nonlinear Optical Phosphate with a Short Absorption Edge, Angew. Chem. Int. Ed. 2015, 54, 4217-4221. DOI: 10.1002/anie.201411772.
42.?Zhao, Sangen; Gong, Pifu; Luo, Siyang; Bai, Lei; Lin, Zheshuai*; Ji, Chengmin; Chen, Tianliang; Hong, Maochun; Luo, Junhua*, Deep-Ultraviolet Transparent Phosphates RbBa2(PO3)5 and Rb2Ba3(P2O7)2 Show Nonlinear Optical Activity from Condensation of [PO4]3- Units, J. Am. Chem. Soc. 2014, 136, 8560-8563. DOI: 10.1021/ja504319x.
43.?Li, Wei; Thirumurugan, A.; Barton, Phillip T.; Lin, Zheshuai*; Henke, Sebastian; Yeung, Hamish H. -M.; Wharmby, Michael T.; Bithell, Erica G.; Howard, Christopher J.; Cheetham, Anthony K.*, Mechanical Tunability via Hydrogen Bonding in Metal-Organic Frameworks with the Perovskite Architecture, J. Am. Chem. Soc. 2014, 136, 7801-7804. DOI: 10.1021/ja500618z.
44.?Zhao, Sangen; Gong, Pifu; Bai, Lei; Xu, Xiang; Zhang, Shuquan; Sun, Zhihua; Lin, Zheshuai*; Hong, Maochun; Chen, Chuangtian; Luo, Junhua*, Beryllium-free Li4Sr(BO3)2 for deep-ultraviolet nonlinear optical applications, Nat. Comm. 2014, 5, 4019. DOI: 10.1038/ncomms5019.
45.?Zhang, Gang; Li, Yanjun; Jiang, Kui; Zeng, Huiyi; Liu, Tao; Chen, Xingguo; Qin, Jingui*; Lin, Zheshuai*; Fu, Peizhen; Wu, Yicheng; Chen, Chuangtian, A New Mixed Halide, Cs2HgI2Cl2: Molecular Engineering for a New Nonlinear Optical Material in the Infrared Region, J. Am. Chem. Soc. 2012, 134, 14818-14822. DOI: 10.1021/ja3037299.