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RESEARCH PAPER · RSC Advances · 2017

Theoretical investigation on the balance between large band gap and strong SHG response in BMO 4 (M = P and As) crystals

Yanzhou Sun, Zhihua Yang, Dianwei Hou, Shilie Pan

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22 direct citing papers in this saved network. Explore the next layer with second-order citations.

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Theoretical investigation on the balance between large band gap and strong SHG response in BMO 4 (M = P and As) crystalsOriginalUnusual observation of optical property of V 5+ substituted BPO 4 and its tunable redox features7M3+(H2AsO4)(H2As2O7) (M3+= Al, Ga) and In2(H2AsO4)2(H2As2O7)2: a new layer structure type and a new framework structure type containing the rare H2As2O72−group7RbFe(HAsO4)2 and TlFe(HAsO4)2, two new hydrogenarsenates adopting two closely related structure types5M+M3+2As(HAsO4)6and α- and β-M+M3+(HAsO4)2(M+M3+= RbAl or CsFe): six new compounds crystallizing in three closely related structure types6Sn[B2O3F2]—The First Tin Fluorooxoborate as Possible NLO Material102M + M 3+ 2As(HAsO4)6 (M + M 3+ = TlGa, CsGa, CsAl): three new metal arsenates containing AsO6 octahedra3Cation substitution inducing gap changes and covalent interaction flexibility enhancing second harmonic generation responses in d10 metal chalcogenides11Tailoring nonlinear optical crystal borophosphate through the introduction of transition metal d orbitals for improving optical anisotropy and SHG response: a first-principles investigation1(NH4)Ga(HAsO4)2 and TlAl(HAsO4)2 - two new RbFe(HPO4)2-type M + M 3+ arsenates2CsGa(HAsO4)2, the first Ga representative of the RbAl(HAsO4)2structure type0Two new ammonium/alkali-rare earth metal difluorophosphates ALa(PO 2 F 2 ) 4 (A = NH 4 and K) with moderate birefringence and short cutoff edges26Temperature dependence on dielectric and ferroelectric properties of rubidium titanyl phosphate single crystal7Experimental and theoretical investigations of propyl para-hydroxybenzoate crystal for optical applications4Single crystal growth and phase transition mechanism of KCsMoP 2 O 9 with efficient second harmonic generation via the emerging additional periodic phase technology4Orbital Hybridization and Hypersensitivity of Eu3+ in YXO4 (X=P, As, V)2Study of the electronic, elastic, piezoelectric and infrared properties of trigonal BPO45Deep-ultraviolet (DUV) nonlinear optical (NLO) crystals: An application in photonic technologies29Unbiased screening of deep-ultraviolet and mid-infrared nonlinear optical crystals: Long-neglected covalent and mixed-cation motifs9MgPO2F3: An Ultraviolet Nonlinear Optical System with an Extremely Short Phase-Matching Wavelength Achieved by Introducing Dual-Type Fluorine via Structure Prediction1Computational Identification of Four Promising Nonlinear Optical Materials for Near and Middle Ultraviolet Operation6Design and evaluation of indacenothienothiophene based functional materials for second and third order nonlinear optics properties via DFT approach12Carbon Cage Nanosensors for Selective Detection of Toxic Gas Molecules0

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  1. Unusual observation of optical property of V 5+ substituted BPO 4 and its tunable redox features

    Materials Research Bulletin · 2017-03-14

    Buvaneswari Gopal, Aishwarya Muralidharan, Rangarajan Bakthavatsalam, Subramanian Nellaiappan, Annamalai Senthil Kumar

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  2. M3+(H2AsO4)(H2As2O7) (M3+= Al, Ga) and In2(H2AsO4)2(H2As2O7)2: a new layer structure type and a new framework structure type containing the rare H2As2O72−group

    Acta Crystallographica Section C Structural Chemistry · 2017-07-06

    Karolina Schwendtner, Uwe Kolitsch

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  3. RbFe(HAsO4)2 and TlFe(HAsO4)2, two new hydrogenarsenates adopting two closely related structure types

    Acta Crystallographica Section E Crystallographic Communications · 2018-05-01

    Karolina Schwendtner, Uwe Kolitsch

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  4. M+M3+2As(HAsO4)6and α- and β-M+M3+(HAsO4)2(M+M3+= RbAl or CsFe): six new compounds crystallizing in three closely related structure types

    Acta Crystallographica Section C Structural Chemistry · 2018-05-23

    Karolina Schwendtner, Uwe Kolitsch

    Read original paper ↗ ·

  5. Sn[B2O3F2]—The First Tin Fluorooxoborate as Possible NLO Material

    Advanced Optical Materials · 2018-06-25

    Stephan G. Jantz, Marwin Dialer, Lkhamsuren Bayarjargal, Björn Winkler, Leo van Wüllen, Florian Pielnhofer, Jakoah Brgoch, Richard Weihrich, Henning A. Höppe

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  6. M + M 3+ 2As(HAsO4)6 (M + M 3+ = TlGa, CsGa, CsAl): three new metal arsenates containing AsO6 octahedra

    Acta Crystallographica Section E Crystallographic Communications · 2018-07-26

    Karolina Schwendtner, Uwe Kolitsch

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  7. Cation substitution inducing gap changes and covalent interaction flexibility enhancing second harmonic generation responses in d10 metal chalcogenides

    Journal of Alloys and Compounds · 2018-07-30

    Jianian Cheng, Ming‐Hsien Lee, Jun Zhang

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  8. Tailoring nonlinear optical crystal borophosphate through the introduction of transition metal d orbitals for improving optical anisotropy and SHG response: a first-principles investigation

    Materials Research Express · 2018-08-06

    Jinyu Hu, Jing Wei, Yongfan Zhang, Qiaohong Li, Kechen Wu

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  9. (NH4)Ga(HAsO4)2 and TlAl(HAsO4)2 - two new RbFe(HPO4)2-type M + M 3+ arsenates

    Acta Crystallographica Section E Crystallographic Communications · 2018-09-28

    Karolina Schwendtner, Uwe Kolitsch

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  10. CsGa(HAsO4)2, the first Ga representative of the RbAl(HAsO4)2structure type

    Acta Crystallographica Section E Crystallographic Communications · 2019-02-08

    Karolina Schwendtner, Uwe Kolitsch

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  11. Two new ammonium/alkali-rare earth metal difluorophosphates ALa(PO 2 F 2 ) 4 (A = NH 4 and K) with moderate birefringence and short cutoff edges

    Dalton Transactions · 2020-01-01

    Wenyao Zhang, Zhonglei Wei, Zhihua Yang, Shilie Pan

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  12. Temperature dependence on dielectric and ferroelectric properties of rubidium titanyl phosphate single crystal

    Journal of Materials Science Materials in Electronics · 2020-03-14

    Rajesh Narayana Perumal, Arulmani Marimuthu

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  13. Experimental and theoretical investigations of propyl para-hydroxybenzoate crystal for optical applications

    Journal of Materials Science Materials in Electronics · 2021-09-13

    Krishan Kumar, S. Rajathi, V. Charles Vincent, R. Sangeetha, G. Bakiyaraj, K. Kirubavathi, Kuthambalam Selvaraju, G. Vinitha

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  14. Single crystal growth and phase transition mechanism of KCsMoP 2 O 9 with efficient second harmonic generation via the emerging additional periodic phase technology

    Journal of Materials Chemistry C · 2023-01-01

    Mengdi Fan, Guangda Wu, Lili Li, Fapeng Yu, Chunhui Wang, Xiufeng Cheng, Xian Zhao

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  15. Orbital Hybridization and Hypersensitivity of Eu3+ in YXO4 (X=P, As, V)

    ECS Journal of Solid State Science and Technology · 2023-05-23

    A.M. Srivastava, M.G. Brik, William Winder Beers, B. Lou, Chong‐Geng Ma, Michał Piasecki, William Erwin Cohen

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  16. Study of the electronic, elastic, piezoelectric and infrared properties of trigonal BPO4

    Materials Today Communications · 2023-06-24

    Zhiqiang Zhen, Hong‐Ling Cui, Haiyan Wang

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  17. Deep-ultraviolet (DUV) nonlinear optical (NLO) crystals: An application in photonic technologies

    Optical Materials · 2023-08-23

    Biswajit Dalai, Sarat Kumar Dash

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  18. Unbiased screening of deep-ultraviolet and mid-infrared nonlinear optical crystals: Long-neglected covalent and mixed-cation motifs

    Physical Review Materials · 2024-08-19

    Jizhang Wang, Meng Ye, Xiaomi Guo, Yang Li, Nianlong Zou, He Li, Zetao Zhang, Sibo Zhao, Zhiming Xu, Haowei Chen, Dezhao Wu, Ting Bao, Yong Mao Xu, Wenhui Duan

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  19. MgPO2F3: An Ultraviolet Nonlinear Optical System with an Extremely Short Phase-Matching Wavelength Achieved by Introducing Dual-Type Fluorine via Structure Prediction

    The Journal of Physical Chemistry C · 2024-11-26

    Xue Bai, Xin Su, Wenqi Jin

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  20. Computational Identification of Four Promising Nonlinear Optical Materials for Near and Middle Ultraviolet Operation

    Journal of Experimental and Theoretical Physics Letters · 2025-02-01

    Y. Alkabakibi, D. D. Barma, Dmitry V. Rybkovskiy, Abudukadi Tudi, Congwei Xie, Артем Ромаевич Оганов

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  21. Design and evaluation of indacenothienothiophene based functional materials for second and third order nonlinear optics properties via DFT approach

    Scientific Reports · 2025-04-17

    Saadia Haq, Muhammad Khalid, Ataualpa Albert Carmo Braga, Norah Saad Alhokbany, Ke Chen

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  22. Carbon Cage Nanosensors for Selective Detection of Toxic Gas Molecules

    ACS Omega · 2026-03-13

    Laith Abdulhassan Algharagholy, Qusiy H. Al-Galiby, Víctor Manuel García-Suárez, Isam Nghaimesh Taeb

    Read original paper ↗ ·
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