RESEARCH ARTICLE · Inorganic Chemistry Frontiers · 2024

Shooting short-wavelength nonlinear optical materials with targeted balance performances in hydroxyborates through first-principles high-throughput screening

chenxu li, Abudukadi Tudi, Huanhuan Cheng, Qing‐Yu Liu, Zhihua Yang, Shilie Pan

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Hydroxyl-induced structural reconstruction: two new potassium hepta-borates with deep-UV transparency and enhanced birefringence
Inorganic Chemistry Frontiers · 2025
Meng Cheng, Wenbin Zhang, Wenqi Jin, Артем Ромаевич Оганов, Zhihua Yang, Shilie Pan
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First Principles Calculations of Structures, Mechanical and Vibrational Properties of Nonlinear Optical LiZnCO3(OH) and NaZnCO3(OH) Crystals
Journal of Structural Chemistry · 2026
Yu. N. Zhuravlev, Е.В. Гвоздикова
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F−/OH− terminal modification of [B3O6] clusters: Constructing deep-ultraviolet hydroxyfluorooxoborates with tunable optical performance
Materials Today Chemistry · 2026
Dahong Peng, Hongkang Su, Ziting Yan, chenxu li, Shilie Pan, Min Zhang
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Advances in metal selenite nonlinear optical materials: halogens directed structure modulation and property optimization
Coordination Chemistry Reviews · 2026
Dan-Dan Zhou, Tian-Tian He, Chun‐Li Hu, Jiang‐Gao Mao, Fang Kong
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Shooting short-wavelength nonlinear optical materials with targeted balance performances in hydroxyborates through first-principles high-throughput screening

See where this research leads.

Papers that cite this work

Hydroxyl-induced structural reconstruction: two new potassium hepta-borates with deep-UV transparency and enhanced birefringence

First Principles Calculations of Structures, Mechanical and Vibrational Properties of Nonlinear Optical LiZnCO3(OH) and NaZnCO3(OH) Crystals

F−/OH− terminal modification of [B3O6] clusters: Constructing deep-ultraviolet hydroxyfluorooxoborates with tunable optical performance

Advances in metal selenite nonlinear optical materials: halogens directed structure modulation and property optimization