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RESEARCH PAPER · Physical Chemistry Chemical Physics · 2014

The influence of hydrogen bonding on the nonlinear optical properties of a semiorganic material NH 4 B[ d -(+)-C 4 H 4 O 5 ] 2 ·H 2 O: a theoretical perspective

Lei Chen, Zhihua Yang, Bingbing Zhang, Ming‐Hsien Lee, Qun Jing, Zhaohui Chen, Xuchu Huang, Ying Wang, Shilie Pan, Muhammad Ramzan Saeed Ashraf Janjua

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The influence of hydrogen bonding on the nonlinear optical properties of a semiorganic material NH 4 B[ d -(+)-C 4 H 4 O 5 ] 2 ·H 2 O: a theoretical perspectiveOriginalEffect of cation substitution on structural transition: synthesis, characterization and theoretical studies of NaCa 4 B 3 O 9 , NaCaBO 3 , NaSrBO 3 and Li 4 CaB 2 O 618Ba2B6O11, a Member of the BaO‐B2O3 Family, Featuring a Layer Framework19Ba(dl-C4H4O5) — An alkaline earth metal-dicarboxylate hybrid crystal with the synergy of multi-bonds3Strong Solvent Effects on the Nonlinear Optical Properties of Z and E Isomers from Azo-Enaminone Derivatives64Growth and charatcterisation of mercuric chloride doped urea single crystals11Hydrogen bonded R22(8) graph set in inducing charge transfer mechanism in guanidinium-3,5-dinitrobenzoate: A combined experimental, theoretical and Hirshfeld surface study47Intrinsic Electronic Structures and Optical Anisotropy of α- and β-Phase Copper Phthalocyanine Molecular Crystals0A comparative analysis on optical, photo luminescence and laser damage properties of conventional and uniaxial method grown semi organic nonlinear optical material – sodium potassium tartrate tetrahydrate3Nonlinear optical and G-Quadruplex DNA stabilization properties of novel mixed ligand copper(II) complexes and coordination polymers: Synthesis, structural characterization and computational studies19Study of the nonlinear optical properties of 4-nitroaniline type compounds by density functional theory calculations: Towards new NLO materials29Far-field diffraction patterns and optical limiting properties of bisdemethoxycurcumin solution under CW laser illumination43In depth study on growth aspects and characteristic properties of semiorganic nonlinear optical crystal: 4-Dimethylaminopyridine copper chloride17Cell culture medium and nano-confined water on nonlinear optical properties of Congo Red19Hydrogen bond analysis of a third order nonlinear optical crystal, 2-amino-5-bromopyridinium benzilate, using structural and computational characterizations14Fluorooxoborate layers: second harmonic generation and Raman spectra anisotropy2Synthesis, growth, structural, thermal, mechanical and optical properties of barium guanidinium dichloride (BaGuCl2) single crystal for NLO applications7Synthesis, growth and characterization of guanidinium hippurate monohydrate single crystals: A new third order nonlinear optical material15A Highly Stable Microporous Calcium-Based MOF for C2H2/CO2 Separation with Low Regenerative Energy21Cycloaddition reaction of methylidyne radical with dipyrromethanol: quantum chemical insights into the formation of di(pyridin-2-yl)methanol3A path to the formation of superacids HPtnF5n+1(n=1–3) and their ability to form supersalts by using the ab initio technique0Cooperative electronic effects of Na + and Ca 2+ on an oxygenated aromatic model0Solvent-driven modulation of structural and nonlinear optical properties of a novel hydrazide derivative: synthesis, DFT, and TD-DFT study1Synthesis, structural elucidation, hirshfeld surface analysis, DFT studies, and nonlinear optical exploration of a schiff base derivative: an experimental and computational approach1

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  1. Effect of cation substitution on structural transition: synthesis, characterization and theoretical studies of NaCa 4 B 3 O 9 , NaCaBO 3 , NaSrBO 3 and Li 4 CaB 2 O 6

    Physical Chemistry Chemical Physics · 2015-01-01

    Yun Mo Yang, Xin Su, Shilie Pan, Zhihua Yang

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  2. Ba2B6O11, a Member of the BaO‐B2O3 Family, Featuring a Layer Framework

    European Journal of Inorganic Chemistry · 2015-06-24

    Lili Liu, Yun Mo Yang, Xiaoyu Dong, Lei Chen, Shujuan Han, Shilie Pan

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  3. Ba(dl-C4H4O5) — An alkaline earth metal-dicarboxylate hybrid crystal with the synergy of multi-bonds

    Inorganic Chemistry Communications · 2015-08-17

    Lei Chen, Zheng Wang, Fangyuan Zhang, Fangyuan Zhang, Zhihua Yang, Fangfang Zhang, Fangfang Zhang, Ying Wang, Shilie Pan

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  4. Strong Solvent Effects on the Nonlinear Optical Properties of Z and E Isomers from Azo-Enaminone Derivatives

    The Journal of Physical Chemistry C · 2016-07-22

    Daniel F. S. Machado, Thiago O. Lopes, Igo Tôrres Lima, Demétrio A. da Silva Filho, Heibbe C. B. de Oliveira

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  5. Growth and charatcterisation of mercuric chloride doped urea single crystals

    Materials Research Innovations · 2017-01-04

    Medikere Revanasiddappa Jagadeesh, H.M. Suresh Kumar, R. Ananda Kumari

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  6. Hydrogen bonded R22(8) graph set in inducing charge transfer mechanism in guanidinium-3,5-dinitrobenzoate: A combined experimental, theoretical and Hirshfeld surface study

    Journal of Molecular Structure · 2017-02-17

    P. Muthuraja, T. Joselin Beaula, T. Shanmugavadivu, V. Bena Jothy, M. Dhandapani

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  7. Intrinsic Electronic Structures and Optical Anisotropy of α- and β-Phase Copper Phthalocyanine Molecular Crystals

    Applied Mechanics and Materials · 2017-04-01

    Xue Yan Wang, Jian Zheng, Xiao Jiang Li, Chongde Cao

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  8. A comparative analysis on optical, photo luminescence and laser damage properties of conventional and uniaxial method grown semi organic nonlinear optical material – sodium potassium tartrate tetrahydrate

    Materials Research Innovations · 2017-11-24

    R. Purusothaman, M. Shankar, A. Dennis Raj, Mark Vimalan, K. Rajarajan, I. Vetha Potheher

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  9. Nonlinear optical and G-Quadruplex DNA stabilization properties of novel mixed ligand copper(II) complexes and coordination polymers: Synthesis, structural characterization and computational studies

    Journal of Molecular Structure · 2017-12-11

    Bathula Rajasekhar, Navya Bodavarapu, M. Sridevi, G. Thamizhselvi, K. RizhaNazar, Ramanathan Padmanaban, Toka Swu

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  10. Study of the nonlinear optical properties of 4-nitroaniline type compounds by density functional theory calculations: Towards new NLO materials

    Computational and Theoretical Chemistry · 2018-04-25

    Said Figueredo López, Manuel Páez Meza, Francisco Torres-Hoyos

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  11. Far-field diffraction patterns and optical limiting properties of bisdemethoxycurcumin solution under CW laser illumination

    Optical Materials · 2018-09-21

    Hassan A. Sultan, QUSAY MOHAMMED ALI HASSAN, Ahmed S. Al-Asadi, Rita Sabah Elias, H. Bakr, Bahjat Ali Saeed, Chassib A. Emshary

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  12. In depth study on growth aspects and characteristic properties of semiorganic nonlinear optical crystal: 4-Dimethylaminopyridine copper chloride

    Materials Science for Energy Technologies · 2019-02-25

    J. Johnson, R. Srineevasan, D. Sivavishnu

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  13. Cell culture medium and nano-confined water on nonlinear optical properties of Congo Red

    Optical and Quantum Electronics · 2019-04-27

    Mehdi Hoseini, Ameneh Sazgarnia, Soheil Sharifi

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  14. Hydrogen bond analysis of a third order nonlinear optical crystal, 2-amino-5-bromopyridinium benzilate, using structural and computational characterizations

    Journal of Molecular Structure · 2019-11-16

    S. Madhankumar, P. Muthuraja, M. Dhandapani

    Read original paper ↗ ·

  15. Fluorooxoborate layers: second harmonic generation and Raman spectra anisotropy

    New Journal of Chemistry · 2020-01-01

    Abudukadi Tudi, Shujuan Han, Zhihua Yang, Shilie Pan

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  16. Synthesis, growth, structural, thermal, mechanical and optical properties of barium guanidinium dichloride (BaGuCl2) single crystal for NLO applications

    Journal of Optics · 2020-07-30

    M. P. Nancy, J. Mary Linet

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  17. Synthesis, growth and characterization of guanidinium hippurate monohydrate single crystals: A new third order nonlinear optical material

    Optical Materials · 2020-10-12

    Jerin Susan John, T. Arumanayagam, P. Murugakoothan, Davidson Sajan, Nithin Joy, Reji Philip

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  18. A Highly Stable Microporous Calcium-Based MOF for C2H2/CO2 Separation with Low Regenerative Energy

    Inorganic Chemistry · 2024-04-22

    Lulu Zhang, Feifan Lang, Xiao‐Juan Xi, Shunxian Yin, Jiandong Pang, Wenjun Zheng, Xian‐He Bu

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  19. Cycloaddition reaction of methylidyne radical with dipyrromethanol: quantum chemical insights into the formation of di(pyridin-2-yl)methanol

    Spectroscopy Letters · 2024-05-16

    Shipra Pandit, Manas Ranjan Dash

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  20. A path to the formation of superacids HPtnF5n+1(n=1–3) and their ability to form supersalts by using the ab initio technique

    Journal of the Indian Chemical Society · 2024-12-15

    Vijay Singh, Divyanshi Shukla, Apoorva Dwivedi, D.D. Dubey, Sugriva Nath Tiwari, Said Ali Hamad Vuai, Anoop Kumar Pandey

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  21. Cooperative electronic effects of Na + and Ca 2+ on an oxygenated aromatic model

    New Journal of Chemistry · 2026-01-01

    Yuji Shinohara, Naoto Tsubouchi

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  22. Solvent-driven modulation of structural and nonlinear optical properties of a novel hydrazide derivative: synthesis, DFT, and TD-DFT study

    Computational and Theoretical Chemistry · 2026-03-23

    Jenia Afrin Tanni, Md. Sohel Rana, Md. Abdur Rakib, Sultana Shakila Khan, Md. Abdul Alim, Dr Tapan Kumar Biswas, Md. Belayet Hossain Howlader, Md. Chanmiya Sheikh, Ennio Zangrando, Md. Rezaul Haque Ansary

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  23. Synthesis, structural elucidation, hirshfeld surface analysis, DFT studies, and nonlinear optical exploration of a schiff base derivative: an experimental and computational approach

    Journal of Materials Science Materials in Electronics · 2026-05-01

    Karthik V․, Anand Sekar, S. Neetha, T.N. Lohith, Rajiv Patel, Neelamma Basayya Gummagol, M. A. Sridhar

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