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RESEARCH PAPER · RSC Advances · 2015

ACdCO 3 F (A = K and Rb): new noncentrosymmetric materials with remarkably strong second-harmonic generation (SHG) responses enhanced via π-interaction

Guohong Zou, Gnu Nam, Hyung Gu Kim, Hongil Jo, Tae‐Soo You, Kang Min Ok

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ACdCO 3 F (A = K and Rb): new noncentrosymmetric materials with remarkably strong second-harmonic generation (SHG) responses enhanced via π-interactionOriginalChemInform Abstract: ACdCO3F (A: K and Rb): New Noncentrosymmetric Materials with Remarkably Strong Second‐Harmonic Generation (SHG) Responses Enhanced via π‐Interaction.0Synthesis and characterization of CsSrCO 3 F – a beryllium-free new deep-ultraviolet nonlinear optical material34BaCdSnS 4 and Ba 3 CdSn 2 S 8 : syntheses, structures, and non-linear optical and photoluminescence properties97Nonlinear optical and self-activated luminescent properties of A 2 W 3 O 10 (A = Rb and Cs)12Nonlinear optical response mechanism of noncentrosymmetric lead borate Pb 6 [B 4 O 7 (OH) 2 ] 3 with three crystallographically independent [B 4 O 7 (OH) 2 ] 4− chains8Design and Syntheses of Three Novel Carbonate Halides: Cs 3 Pb 2 (CO 3 ) 3 I, KBa 2 (CO 3 ) 2 F, and RbBa 2 (CO 3 ) 2 F29Synthesis, crystal structures and luminescence properties of rare earth-cadmium hydroxycarbonats with the formula RE2Cd(CO3)(OH)6 (RE = Y, Er)5Nonlinear optical (NLO) properties and temperature-dependent photoluminescence in activator-doped noncentrosymmetric (NCS) bismuth tellurite solid solutions, Bi2−Ln TeO5 (Ln = Ce and Eu)8Polar Noncentrosymmetric ZnMoSb2O7 and Nonpolar Centrosymmetric CdMoSb4O10: d10 Transition Metal Size Effect Influencing the Stoichiometry and the Centricity38A High Laser Damage Threshold and a Good Second-Harmonic Generation Response in a New Infrared NLO Material: LiSm3SiS725SrNO3(OH)·H2O: A new member in strontium nitrate hydrate family with an ultraviolet cut-off edge7A Polar Titanium–Organic Chain with a Very Large Second-Harmonic-Generation Response5Toward the Rational Design of Novel Noncentrosymmetric Materials: Factors Influencing the Framework Structures601Mixed-Metal Carbonate Fluorides as Deep-Ultraviolet Nonlinear Optical Materials259A promising lead-free fluoride carbonate SHG material designed from a theoretical perspective16Collaborative enhancement from Pb 2+ and F − in Pb 2 (NO 3 ) 2 (H 2 O)F 2 generates the largest second harmonic generation effect among nitrates91Crystal growth and optical properties of a UV nonlinear optical material KSrCO 3 F73Experimental and ab initio studies of two UV nonlinear optical materials15Role of spin–orbit interaction on the nonlinear optical response of CsPbCO 3 F using DFT35Theoretical perspectives on the structure, electronic, and optical properties of titanosilicates Li 2 M 4 [(TiO)Si 4 O 12 ] (M = K + , Rb + )13In situ Alkylation of 4,4′‐Vinylenedipyridine for Inorganic‐Organic Iodides/Iodidomercurates6Comparative Interrelationship of the Structural, Nonlinear-Optical and Other Acentric Properties for Oxide, Borate and Carbonate Crystals16Li2HgMS4 (M = Si, Ge, Sn): New Quaternary Diamond-Like Semiconductors for Infrared Laser Frequency Conversion64Synthesis, second-harmonic generations (SHG), and photoluminescence (PL) properties of Ca 4 Bi 6-x Ln x O 13 (Ln=La and Eu) solid solutions3Design and Synthesis of a Series of Novel Mixed Borate and Carbonate Halides21A cation size effect on the framework structures in ABi 2 SeO 3 F 5 (A = K and Rb): first examples of alkali metal bismuth selenite fluorides14Cs 3 VO(O 2 ) 2 CO 3 : an exceptionally thermostable carbonatoperoxovanadate with an extremely large second-harmonic generation response129The second-harmonic generation intensification derived from localization conjugated π-orbitals in O 2 2−39Electronic, optical, infrared, and elastic properties of KCdCO3F from first principles2Recent advances in ultraviolet and deep-ultraviolet second-order nonlinear optical crystals257The relationship between covalent bonds and the optical response in a nonpolar family ATeMoO 6 (A=Mg, Zn, Cd): A Berry-phase investigation14Combination of d 10 -cations and fluorine anion as active participants to design novel borate/carbonate nonlinear optical materials24Second-order nonlinear optical crystals with mixed anions250The linear and nonlinear optical response of CsGeX3 (X=Cl, Br, and I): The finite field and first-principles investigation26Investigation on two new antimony-based quaternary chalcogenides: Na 6 CdSb 4 S 10 and Na 3 CdSbSe 41Modulation of perovskite-related frameworks induced by alkaline earth metals in phosphate fluorides A 2 MPO 4 F (A = K, Rb; M = Ba, Ca)8RbSbSO 4 Cl 2 : an excellent sulfate nonlinear optical material generated due to the synergistic effect of three asymmetric chromophores79Y 8 O(OH) 15 (CO 3 ) 3 Cl: an excellent short-wave UV nonlinear optical material exhibiting an infrequent three-dimensional inorganic cationic framework61Bi2Te2O6(NO3)2(OH)2(H2O): A layered bismuth tellurium nitrate hydroxide with multiple noncentrosymmetric chromophores14Layered Bismuth Oxyfluoride Nitrates Revealing Large Second-Harmonic Generation and Photocatalytic Properties37Designing Three Fluorooxoborates with a Wide Transmittance Window by Anionic Group Substitution15Crystal structure and second harmonic generation in Bi2TeO5: An X-N study from synchrotron and neutron diffraction data8Mixed lone-pair and mixed anion compounds: Pb3(SeO3)(HSeO3)Br3, Pb3(SeO3)(OH)Br3, CdPb8(SeO3)4Cl4Br6 and RbBi(SeO3)F218Na2Mg1−xZnxSiO4 (0 ≤ x ≤ 1): Noncentrosymmetric Sodium Metal Silicate Solid Solutions with Ultraviolet Nonlinear Optical Properties71Hydrogen-Bond-Assisted Reinforcement of Interlayer Connections in Zn2BO3X·H2O (X = Cl, Br): Two UV Nonlinear Optical Crystals with KBBF-Type Structure9NLO response as a function of structural water presence: A comparative experimental (UV-vis) and DFT (structural, NPA, MEP) study on Cs2Ni(SeO4)2•4H2O and Cs2Ni(SeO4)220Unique synthesis, structure determination, and optical properties of seven new layered rare earth tellurite nitrates, RE(TeO3)(NO3) (RE = La, Nd, Eu, Gd, Dy, Er, and Y)15Novel noncentrosymmetric polar coordination compounds derived from chiral histidine ligands36Systematic centricity control using a chiral template: novel noncentrosymmetric polar niobium oxyfluorides and tantalum fluorides directed by chiral histidinium cations, [( l -hisH 2 )NbOF 5 ], [( d -hisH 2 )NbOF 5 ], [( l -hisH 2 )TaF 7 ], and [( d -hisH 2 )TaF 7 ]8Second-order nonlinear optical property of the ultraviolet transparent alkali metal-rare earth metal carbonate Na3Y(CO3)3.3H2O5Synthesis, characterization and optical properties of three novel lanthanide sulfates10An Overview on Recent Trends in Deep‐Ultraviolet (DUV) and Ultraviolet (UV) Nonlinear Optical Crystals25Cation-anion interaction effect on the nonlinear optical behavior of pyridinium-based ionic liquids7Nonlinear optical properties of a new polar bismuth tellurium oxide fluoride, Bi3F(TeO3)(TeO2F2)315Chiral coordination compounds with exceptional enantioselectivity10Coordination metal effect on the nonlinear optical properties and biological activity of double selenates8Chemical Bonding Effects and Physical Properties of Noncentrosymmetric Hexagonal Fluorocarbonates ABCO3F (A: K, Rb, Cs; B: Mg, Ca, Sr, Zn, Cd)10Influence of the coordination metal on the thermal properties of double selenates: Theoretical insights and experimental study2Nonlinear optical, dielectric, and piezoelectric properties of hexagonal fluorocarbonates ABCO3F (A: K, Rb, Cs; B: Mg, Ca, Sr, Zn, Cd, Pb) from first principles3Theoretical insight on structure, electronic, and optical properties of two d 0–d 10 electron transition-metal oxyhalides SHG materials2Rational Design and Controlled Synthesis of High-Performance Inorganic Short-Wave UV Nonlinear Optical Materials150

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  1. ChemInform Abstract: ACdCO3F (A: K and Rb): New Noncentrosymmetric Materials with Remarkably Strong Second‐Harmonic Generation (SHG) Responses Enhanced via π‐Interaction.

    ChemInform · 2015-12-01

    Guohong Zou, Gnu Nam, Hyung Gu Kim, Hongil Jo, Tae‐Soo You, Kang Min Ok

    Read original paper ↗ ·

  2. Synthesis and characterization of CsSrCO 3 F – a beryllium-free new deep-ultraviolet nonlinear optical material

    New Journal of Chemistry · 2015-12-22

    Qingfei Li, Guohong Zou, Chensheng Lin, Ning Ye

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  3. BaCdSnS 4 and Ba 3 CdSn 2 S 8 : syntheses, structures, and non-linear optical and photoluminescence properties

    Dalton Transactions · 2016-01-01

    Ni Zhen, Kui Wu, Ying Wang, Qiang Li, Wenhui Gao, Dianwei Hou, Zhihua Yang, Huaidong Jiang, Yongjun Dong, Shilie Pan

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  4. Nonlinear optical and self-activated luminescent properties of A 2 W 3 O 10 (A = Rb and Cs)

    RSC Advances · 2016-01-01

    Min Zhang, Zhipeng Lian, Ying Wang, Shilie Pan

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  5. Nonlinear optical response mechanism of noncentrosymmetric lead borate Pb 6 [B 4 O 7 (OH) 2 ] 3 with three crystallographically independent [B 4 O 7 (OH) 2 ] 4− chains

    RSC Advances · 2016-01-01

    Xuefei Wang, Fangfang Zhang, Bing‐Hua Lei, Zhihua Yang, Shilie Pan

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  6. Design and Syntheses of Three Novel Carbonate Halides: Cs 3 Pb 2 (CO 3 ) 3 I, KBa 2 (CO 3 ) 2 F, and RbBa 2 (CO 3 ) 2 F

    Chemistry - A European Journal · 2016-01-28

    Lili Liu, Yun Mo Yang, Xiaoyu Dong, Bingbing Zhang, Ying Wang, Zhihua Yang, Shilie Pan

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  7. Synthesis, crystal structures and luminescence properties of rare earth-cadmium hydroxycarbonats with the formula RE2Cd(CO3)(OH)6 (RE = Y, Er)

    Inorganica Chimica Acta · 2016-02-08

    Jun‐Ling Song, Jian‐Qiu Cui, Chao Wu, Gang Yang, Chi Zhang

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  8. Nonlinear optical (NLO) properties and temperature-dependent photoluminescence in activator-doped noncentrosymmetric (NCS) bismuth tellurite solid solutions, Bi2−Ln TeO5 (Ln = Ce and Eu)

    Journal of Alloys and Compounds · 2016-02-24

    Hongil Jo, Jae Soo Yoo, Kang Min Ok

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  9. Polar Noncentrosymmetric ZnMoSb2O7 and Nonpolar Centrosymmetric CdMoSb4O10: d10 Transition Metal Size Effect Influencing the Stoichiometry and the Centricity

    Inorganic Chemistry · 2016-05-26

    Hongil Jo, Kang Min Ok

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  10. A High Laser Damage Threshold and a Good Second-Harmonic Generation Response in a New Infrared NLO Material: LiSm3SiS7

    Crystals · 2016-09-23

    Ni Zhen, Leyan Nian, Guangmao Li, Kui Wu, Shilie Pan

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  11. SrNO3(OH)·H2O: A new member in strontium nitrate hydrate family with an ultraviolet cut-off edge

    Journal of Alloys and Compounds · 2016-11-03

    Lili Liu, Yun Mo Yang, Linping Li, Zhihua Yang, Shilie Pan

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  12. A Polar Titanium–Organic Chain with a Very Large Second-Harmonic-Generation Response

    Inorganic Chemistry · 2016-11-10

    Bongsu Kim, Seung‐Jin Oh, Hongil Jo, Kang Min Ok

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  13. Toward the Rational Design of Novel Noncentrosymmetric Materials: Factors Influencing the Framework Structures

    Accounts of Chemical Research · 2016-11-14

    Kang Min Ok

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  14. Mixed-Metal Carbonate Fluorides as Deep-Ultraviolet Nonlinear Optical Materials

    Journal of the American Chemical Society · 2016-12-24

    T. Thao Tran, Joshua Young, James M. Rondinelli, P. Shiv Halasyamani

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  15. A promising lead-free fluoride carbonate SHG material designed from a theoretical perspective

    Dalton Transactions · 2017-01-01

    Jinyu Hu, Zuju Ma, Rongjian Sa, Yongfan Zhang, Kechen Wu

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  16. Collaborative enhancement from Pb 2+ and F − in Pb 2 (NO 3 ) 2 (H 2 O)F 2 generates the largest second harmonic generation effect among nitrates

    Chemical Communications · 2017-01-01

    Guang Peng, Yi Jin Yang, Yu‐Huan Tang, Min Luo, Tao Yan, Yuqiao Zhou, Chensheng Lin, Zheshuai Lin, Ning Ye

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  17. Crystal growth and optical properties of a UV nonlinear optical material KSrCO 3 F

    CrystEngComm · 2017-01-01

    Weiguo Zhang, P. Shiv Halasyamani

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  18. Experimental and ab initio studies of two UV nonlinear optical materials

    RSC Advances · 2017-01-01

    Juanjuan Lu, Guoqiang Q. Shi, Hongping Wu, Ming Wen, Dianwei Hou, Zhihua Yang, Fangfang Zhang, Shilie Pan

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  19. Role of spin–orbit interaction on the nonlinear optical response of CsPbCO 3 F using DFT

    Physical Chemistry Chemical Physics · 2017-01-01

    E. Narsimha Rao, G. Vaitheeswaran, A.H. Reshak, S. Auluck

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  20. Theoretical perspectives on the structure, electronic, and optical properties of titanosilicates Li 2 M 4 [(TiO)Si 4 O 12 ] (M = K + , Rb + )

    Physical Chemistry Chemical Physics · 2017-01-01

    Jinyu Hu, Zuju Ma, Rongjian Sa, Yongfan Zhang, Kechen Wu

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  21. In situ Alkylation of 4,4′‐Vinylenedipyridine for Inorganic‐Organic Iodides/Iodidomercurates

    Zeitschrift für anorganische und allgemeine Chemie · 2017-03-14

    Jian‐Qiu Cui, Tian‐Shuo Guo, Kaibin Chu, Chao Wu, Gang Yang, Jun‐Ling Song, Chi Zhang

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  22. Comparative Interrelationship of the Structural, Nonlinear-Optical and Other Acentric Properties for Oxide, Borate and Carbonate Crystals

    Crystals · 2017-04-12

    Boris I. Kidyarov

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  23. Li2HgMS4 (M = Si, Ge, Sn): New Quaternary Diamond-Like Semiconductors for Infrared Laser Frequency Conversion

    Crystals · 2017-04-12

    Kui Wu, Shilie Pan

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  24. Synthesis, second-harmonic generations (SHG), and photoluminescence (PL) properties of Ca 4 Bi 6-x Ln x O 13 (Ln=La and Eu) solid solutions

    Journal of Solid State Chemistry · 2017-05-04

    Hoyong Jung, Hongil Jo, Seung‐Jin Oh, Kang Min Ok

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  25. Design and Synthesis of a Series of Novel Mixed Borate and Carbonate Halides

    Chemistry - A European Journal · 2017-06-02

    Lili Liu, Yun Mo Yang, Junben Huang, Xiaoyu Dong, Zhihua Yang, Shilie Pan

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  26. A cation size effect on the framework structures in ABi 2 SeO 3 F 5 (A = K and Rb): first examples of alkali metal bismuth selenite fluorides

    Dalton Transactions · 2018-01-01

    Shuangshuang Shi, Min Luo, Chensheng Lin, Ning Ye

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  27. Cs 3 VO(O 2 ) 2 CO 3 : an exceptionally thermostable carbonatoperoxovanadate with an extremely large second-harmonic generation response

    Chemical Science · 2018-01-01

    Guohong Zou, Zhien Lin, Hongmei Zeng, Hongil Jo, Seong‐Ji Lim, Tae‐Soo You, Kang Min Ok

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  28. The second-harmonic generation intensification derived from localization conjugated π-orbitals in O 2 2−

    Chemical Communications · 2018-01-01

    Yunxia Song, Min Luo, Fei Liang, Ning Ye, Zheshuai Lin

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  29. Electronic, optical, infrared, and elastic properties of KCdCO3F from first principles

    Journal of Physics and Chemistry of Solids · 2018-02-07

    Xue‐Qian Huang, Han-Yu Xue, Can Zhang, Dongdong Pang, Zhen‐Long Lv, Man-Yi Duan

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  30. Recent advances in ultraviolet and deep-ultraviolet second-order nonlinear optical crystals

    Coordination Chemistry Reviews · 2018-03-15

    Chao Wu, Gang Yang, Mark Graeme Humphrey, Chi Zhang

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  31. The relationship between covalent bonds and the optical response in a nonpolar family ATeMoO 6 (A=Mg, Zn, Cd): A Berry-phase investigation

    Journal of Solid State Chemistry · 2018-04-26

    Qiaoqiao Zhang, Qun Jing, Haiming Duan, Haibin Cao

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  32. Combination of d 10 -cations and fluorine anion as active participants to design novel borate/carbonate nonlinear optical materials

    Journal of Alloys and Compounds · 2018-05-18

    Beenish Bashir, Bingbing Zhang, Shilie Pan, Zhihua Yang

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  33. Second-order nonlinear optical crystals with mixed anions

    Coordination Chemistry Reviews · 2018-08-06

    Yu Pan, Sheng‐Ping Guo, Bin‐Wen Liu, Huaiguo Xue, Guo‐Cong Guo

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  34. The linear and nonlinear optical response of CsGeX3 (X=Cl, Br, and I): The finite field and first-principles investigation

    Optik · 2018-10-25

    Qiaoqiao Zhang, Hahaer Mushahali, Haiming Duan, Ming‐Hsien Lee, Qun Jing

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  35. Investigation on two new antimony-based quaternary chalcogenides: Na 6 CdSb 4 S 10 and Na 3 CdSbSe 4

    New Journal of Chemistry · 2019-01-01

    Yi Huang, Xiaowen Wu, Sadeh Beysen

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  36. Modulation of perovskite-related frameworks induced by alkaline earth metals in phosphate fluorides A 2 MPO 4 F (A = K, Rb; M = Ba, Ca)

    New Journal of Chemistry · 2019-01-01

    Kun Chai, Shichao Cheng, Hongyi Li, Bin Dai

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  37. RbSbSO 4 Cl 2 : an excellent sulfate nonlinear optical material generated due to the synergistic effect of three asymmetric chromophores

    Journal of Materials Chemistry C · 2019-01-01

    Fangfang He, Yalan Deng, Xiaoyu Zhao, Ling Huang, Daojiang Gao, Jian Bi, Xin Wang, Guohong Zou

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  38. Y 8 O(OH) 15 (CO 3 ) 3 Cl: an excellent short-wave UV nonlinear optical material exhibiting an infrequent three-dimensional inorganic cationic framework

    Chemical Communications · 2019-01-01

    Yiting Zhang, Ying Long, Xuehua Dong, Lei Wang, Ling Huang, Hongmei Zeng, Zhien Lin, Xin Wang, Guohong Zou

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  39. Bi2Te2O6(NO3)2(OH)2(H2O): A layered bismuth tellurium nitrate hydroxide with multiple noncentrosymmetric chromophores

    Journal of Solid State Chemistry · 2019-01-11

    Soyon Lee, Hongil Jo, Kang Min Ok

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  40. Layered Bismuth Oxyfluoride Nitrates Revealing Large Second-Harmonic Generation and Photocatalytic Properties

    Inorganic Chemistry · 2019-01-16

    Eun Jeong Cho, Seung‐Jin Oh, Hongil Jo, Junsu Lee, Tae‐Soo You, Kang Min Ok

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  41. Designing Three Fluorooxoborates with a Wide Transmittance Window by Anionic Group Substitution

    Inorganic Chemistry · 2019-03-04

    Dequan Jiang, Guopeng Han, Ying Wang, Hao Li, Zhihua Yang, Shilie Pan

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  42. Crystal structure and second harmonic generation in Bi2TeO5: An X-N study from synchrotron and neutron diffraction data

    Journal of Solid State Chemistry · 2019-04-29

    Carlos Alberto López, E. Bâati, María Teresa Fernández-Díaz, Felix O. Saouma, Joon Ik Jang, J. A. Alonso

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  43. Mixed lone-pair and mixed anion compounds: Pb3(SeO3)(HSeO3)Br3, Pb3(SeO3)(OH)Br3, CdPb8(SeO3)4Cl4Br6 and RbBi(SeO3)F2

    Journal of Solid State Chemistry · 2019-12-10

    Meng Shang, P. Shiv Halasyamani

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  44. Na2Mg1−xZnxSiO4 (0 ≤ x ≤ 1): Noncentrosymmetric Sodium Metal Silicate Solid Solutions with Ultraviolet Nonlinear Optical Properties

    Bulletin of the Korean Chemical Society · 2019-12-15

    Hyeshin Lee, Kang Min Ok

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  45. Hydrogen-Bond-Assisted Reinforcement of Interlayer Connections in Zn2BO3X·H2O (X = Cl, Br): Two UV Nonlinear Optical Crystals with KBBF-Type Structure

    Inorganic Chemistry · 2020-05-13

    Yunxia Song, Guangsai Yang, Pifu Gong, Min Luo, Zheshuai Lin, Ning Ye

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  46. NLO response as a function of structural water presence: A comparative experimental (UV-vis) and DFT (structural, NPA, MEP) study on Cs2Ni(SeO4)2•4H2O and Cs2Ni(SeO4)2

    Journal of Molecular Structure · 2020-08-08

    Rumyana Yankova, Ivaylo Tankov

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  47. Unique synthesis, structure determination, and optical properties of seven new layered rare earth tellurite nitrates, RE(TeO3)(NO3) (RE = La, Nd, Eu, Gd, Dy, Er, and Y)

    Journal of Alloys and Compounds · 2020-08-28

    Hye‐Eun Lee, Hongil Jo, Min Hyung Lee, Kang Min Ok

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  48. Novel noncentrosymmetric polar coordination compounds derived from chiral histidine ligands

    Inorganic Chemistry Frontiers · 2021-01-01

    Wooyoung Seo, Kang Min Ok

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  49. Systematic centricity control using a chiral template: novel noncentrosymmetric polar niobium oxyfluorides and tantalum fluorides directed by chiral histidinium cations, [( l -hisH 2 )NbOF 5 ], [( d -hisH 2 )NbOF 5 ], [( l -hisH 2 )TaF 7 ], and [( d -hisH 2 )TaF 7 ]

    Inorganic Chemistry Frontiers · 2021-01-01

    HeeJung Choi, Kang Min Ok

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  50. Second-order nonlinear optical property of the ultraviolet transparent alkali metal-rare earth metal carbonate Na3Y(CO3)3.3H2O

    Journal of Solid State Chemistry · 2021-02-28

    Chao Wu, Lin Lin, Tianhui Wu, Zhipeng Huang, Chi Zhang

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