Fabrication Of Novel Metal-Free Phosphorous Doped Boron Nitride As UV. Active Photo-Catalyst

Document Type : Articles

Authors

1 Department of Chemistry, Faculty of Science, University of Zakho, Kurdistan Region, Iraq

2 Department of Chemistry, Faculty of Science, University of Sulaimani, Kurdistan Region, Iraq

Abstract

The goal of this research is to create nanostructured metal free phosphorous doped Boron nitride (P-BN) and phosphorous-carbon co-doped Boron nitride (CP-BN) that serve as photocatalysts when exposed to UV light. P-NPs were well diffused in aqueous solution. The nanostructured materials were characterized using XRD, SEM-EDX, and UV-Vis spectrophotometry. Based on the characterization results, phosphorous atoms were doped in the crystal structure of BN. The experimental data and theoretical calculations were used to measure the band gap energy, which was determined to be around 4.2 eV in the experimental case; for this purpose, both Tauc and Kubelka-Munk equations were utilized. Thus, photocatalysis degradation is limited to UV region. To examine the degradation effectiveness of photo-catalysts, toluidine blue (TB) was utilized; it was found that the basic medium was the best for degradation; 16% and 8% of TB were eliminated with CP-BN and P-BN, respectively after one hour degradation. Scavengers such as IPA, Na2C2O4, KBrO3, and ascorbic acid were added to trapping experiments to demonstrate the correct potential energy gap in valance and conduction bands and possible photocatalytic mechanism. Data from trapping experiments show that both the hydroxyl radical and super oxide are responsible for degradation, but electron and hole at valance and conduction bands were of low efficiency because of quick recombination. As regards computational study, the crystal and electronic structures of the P-BN and CP-BN have been studied. The lattice parameters were calculated with the Perdew-Burke-Ernzerhof (PBE), and the bandgaps (Eg) were calculated with the (PBE) as (non-local) instead of local (non-local functional generalized gradient approximations) (GAA). In addition, hybrid functional was also applied including (Becke-3 Parameter-Lee-Yang-Parr) B3LYP and (Heyd–Scuseria–Ernzerhof) exchange–correlation functional HSE06. Hybrid functional B3LYP provided better results and closer to the experimental data of the P-BN and CP-BN compound.

Graphical Abstract

Fabrication Of Novel Metal-Free Phosphorous Doped Boron Nitride As UV. Active Photo-Catalyst

Keywords


[1] N. E. Fard and R. Fazaeli, “A Novel Kinetic Approach for Photocatalytic Degradation of Azo Dye with CdS and Ag/CdS Nanoparticles Fixed on a Cement Bed in a Continuous-Flow Photoreactor,” Int. J. Chem. Kinet.48 (11) (2016) 691–701.
 [2]          M. M. Molla-Babaker and S. A. Idreesb, “Degradation of Congo Red Dye Using Homogeneous Photo Fenton Catalyst Coupled with Oxygen Kinetics and Statistical Analysis,” Asian J. Appl. Chem. Res. 6 (1) (2020) 1–9.
[3] H. A. M. Salim, S. A. Idrees, R. A. Rashid, A. A. Mohammed, S. M. Simo, and I. S. Khalo, “Photo-catalytic degradation of Toluidine Blue Dye in Aqueous Medium under Fluorescent Light,” ICOASE 2018 - Int. Conf. Adv. Sci. Eng. (2018) 384–388.
[4] S. A. Idrees, S. A. Naman, and A. Shorachi, “Kinetic and thermodynamic study of Trifluralin photo-degradation by ultra violet light,” IOP Conf. Ser. Mater. Sci. Eng.454 (1) (2018) 12-45.
[5] A. S. Kasmaei, M. K. Rofouei, M. E. Olya, and S. Ahmed, “Kinetic and Thermodynamic Studies on the Reactivity of Hydroxyl Radicals in Wastewater Treatment by Advanced Oxidation Processes,” Prog. Color. Color. Coatings. 13 (2019)1–10.
[6] T. Chen, Q. Zhang, Z. Xie, C. Tan, P. Chen, Y. Zeng, F. Wang, H. Liu, Y. Liu, G. Liu, and W. Lv, “Carbon nitride modified hexagonal boron nitride interface as highly efficient blue LED light-driven photocatalyst,” Appl. Catal. B Environ.238 (100) (2018) 410–421.
[7] Q. Weng, X. Wang, X. Wang, Y. Bando, and D. Golberg, “Functionalized hexagonal boron nitride nanomaterials: Emerging properties and applications,” Chem. Soc. Rev.45 (14) (2016) 3989–4012.
[8] R. T. Paine and C. K. Narula, “Synthetic Routes to Boron Nitride,” Chem. Rev. 90 (1990) 73–91.
[9] X. F. Jiang, Q. Weng, X. Bin Wang, X. Li, J. Zhang, D. Golberg, and Y. Bando, “Recent Progress on Fabrications and Applications of Boron Nitride Nanomaterials: A Review,” J. Mater. Sci. Technol.31 (6 ) (2015) 589–598.
[10]         J. Yu, L. Qin, Y. Hao, S. Kuang, X. Bai, Y. M. Chong, W. Zhang, and E. Wang, “Vertically aligned boron nitride nanosheets: Chemical vapor synthesis, ultraviolet light emission, and superhydrophobicity,” ACS Nano. 4 ( 2010) 414–422.
[11]         B. Matović, J. Luković, M. Nikolić, B. Babić, N. Stanković, B. Jokić, and B. Jelenković, “Synthesis and characterization of nanocrystaline hexagonal boron nitride powders: XRD and luminescence properties,” Ceram. Int.42 (15) (2016)16655–16658.
[12]         Q. Weng, X. Wang, C. Zhi, Y. Bando, and D. Golberg, “Boron nitride porous microbelts for hydrogen storage,” ACS Nano. 7 (2) (2013)1558–1565.
[13]         P. Wu, W. Zhu, Y. Chao, J. Zhang, P. Zhang, H. Zhu, C. Li, Z. Chen, H. Li, and S. Dai, “A template-free solvent-mediated synthesis of high surface area boron nitride nanosheets for aerobic oxidative desulfurization,” Chem. Commun. 52 (2016)144–147.
[14]         C. Y. Zhi, Y. Bando, T. Terao, C. C. Tang, H. Kuwahara, and D. Golberg, “Chemically activated boron nitride nanotubes,” Chem. - An Asian J. 4 (10) (2009) 1536–1540.
[15]         T. Sainsbury, T. Ikuno, D. Okawa, D. Pacilé, J. M. J. Fréchet, and A. Zettl, “Self-assembly of gold nanoparticles at the surface of amine- and thiol-functionalized boron nitride nanotubes,” J. Phys. Chem. C, vol. 111 (35) (2007) 12992–12999.
[16]         D. Kim, S. Nakajima, T. Sawada, M. Iwasaki, S. Kawauchi, C. Zhi, Y. Bando, D. Golberg, and T. Serizawa, “Sonication-assisted alcoholysis of boron nitride nanotubes for their sidewalls chemical peeling,” Chem. Commun. 51 (33) (2015)7104–7107.
[17]         D. Golberg, Y. Bando, C. Tang, and C. Zni, “Boron nitride nanotubes,” Adv. Mater. 19 (18) ( 2007) 2413–2432.
[18]         F. Guo, J. Zhao, F. Li, D. Kong, H. Guo, X. Wang, H. Hu, L. Zong, and J. Xu, “Polar crystalline phases of PVDF induced by interaction with functionalized boron nitride nanosheets,” CrystEngComm. 22 (37) (2020) 6207–6215.
[19]         Z. He, C. Kim, L. Lin, T. H. Jeon, S. Lin, X. Wang, and W. Choi, “Formation of heterostructures via direct growth CN on h-BN porous nanosheets for metal-free photocatalysis,” Nano Energy. 42 (2017)58–68.
[20]         M. Pelaez, P. Falaras, V. Likodimos, K. O’Shea, A. A. de la Cruz, P. S. M. Dunlop, J. A. Byrne, and D. D. Dionysiou, “Use of selected scavengers for the determination of NF-TiO2 reactive oxygen species during the degradation of microcystin-LR under visible light irradiation,” J. Mol. Catal. A Chem.425 ( 2016) 183–189.
[21]         S. A. Idrees, R. N. Salih, K. Bashir, and A. A. Hamasaeed, “Kinetic Study of Congo-Red Photo-Catalytic Degradation in Aqueous Media Using Zinc Oxide as Photo Catalyst Under Led Light,” Sci. J. Univ. Zakho. 9 ( 2021) 20–24.
[22]         M. R. Hoffmann, S. T. Martin, W. Choi, and D. W. Bahnemann, “Environmental Applications of Semiconductor Photocatalysis,” Chem. Rev. 95 ( 1995) 69–96.
[23]         P. Fernández-Castro, M. Vallejo, M. F. San Román, and I. Ortiz, “Insight on the fundamentals of advanced oxidation processes: Role and review of the determination methods of reactive oxygen species,” J. Chem. Technol. Biotechnol.90 (5) ( 2015) 796–820.
[24]         B. G. Kwon, J.-O. Kim, and J.-K. Kwon, “An Advanced Kinetic Method for HO2∙/O2-∙ Determination by Using Terephthalate in the Aqueous Solution,” Environ. Eng. Res.17 (4) ( 2012) 205–210.
[25]         O. Fónagy, E. Szabó-Bárdos, and O. Horváth, “1,4-Benzoquinone and 1,4-hydroquinone based determination of electron and superoxide radical formed in heterogeneous photocatalytic systems,” J. Photochem. Photobiol. A Chem.407 (2021).
[26]         W. KOHN and L. J. SHAM, “Self-Consistent Equations Including Exchange and Correlation Effects,” Phys. Rev. 140 (4A) ( 1965) A1133–A1137.
[27]         J. P. Perdew, K. Burke, and M. Ernzerhof, “Generalized gradient approximation made simple,” Phys. Rev. Lett., vol. 77, no. 18, pp. 3865–3868, 1996, doi: 10.1103/PhysRevLett.77.3865.
[28]         M. K. Abdel-Sattar and M. Taha, “Electronic structures and optoelectronic properties of ATiOPO4 (A = H, Li, Na, K, Rb, Cs, Fr, NH4, Ag) compounds and their applications in water splitting, CO2 reduction, and photo-degradation,” Mater. Res. Express. 7 (4) 2020.
[29]         R. G. P. Chengteh Lee, Weitao Yang, “Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density,” Phys. Rev. B. 37 (2) ( 1988) 785–789.
[30]         X. Shi, K. Wang, J. Tian, X. Yin, B. Guo, G. Xi, W. Wang, and W. Wu, “Few-Layer Hydroxyl-Functionalized Boron Nitride Nanosheets for Nanoscale Thermal Management,” ACS Appl. Nano Mater.3 (3) (2020) 2310–2321.
[31]         Y. Zhan, J. Yang, L. Guo, F. Luo, B. Qiu, G. Hong, and Z. Lin, “Targets regulated formation of boron nitride quantum dots – Gold nanoparticles nanocomposites for ultrasensitive detection of acetylcholinesterase activity and its inhibitors,” Sensors Actuators, B Chem. 279 ( 2019) 61–68.
[32]         S. Angizi, F. Shayeganfar, M. H. Azar, and A. Simchi, “Surface/edge functionalized boron nitride quantum dots: Spectroscopic fingerprint of bandgap modification by chemical functionalization,” Ceram. Int. 46 ( 2020) 978–985.
[33]         J. H. Jung, M. Kotal, M. H. Jang, J. Lee, Y. H. Cho, W. J. Kim, and I. K. Oh, “Defect engineering route to boron nitride quantum dots and edge-hydroxylated functionalization for bio-imaging,” RSC Adv.6 (77) ( 2016) 73939–73946.
[34]         C. Huang, C. Chen, X. Ye, W. Ye, J. Hu, C. Xu, and X. Qiu, “Stable colloidal boron nitride nanosheet dispersion and its potential application in catalysis,” J. Mater. Chem. A. 1 (39) ( 2013) 12192–12197.
[35]         Ö. Şen, M. Emanet, and M. Çulha, “One-step synthesis of hexagonal boron nitrides, their crystallinity and biodegradation,” Front. Bioeng. Biotechnol. 9 ( 2018) 1–9.
[36]         T. A. Baeraky, Y. H. Afandi, and H. A. Al-Jawhari, “The influence of microwave frequencies at high temperatures on structural properties of h-BN,”  11 (2011) 63-67.
[37]         R. N. Muthu, S. Rajashabala, and R. Kannan, “Hydrogen storage performance of lithium borohydride decorated activated hexagonal boron nitride nanocomposite for fuel cell applications,” Int. J. Hydrogen Energy. 42 (23) (2017)15586–15596.
[38]         J. Xiong, W. Zhu, H. Li, L. Yang, Y. Chao, P. Wu, S. Xun, W. Jiang, M. Zhang, and H. Li, “Carbon-doped porous boron nitride: Metal-free adsorbents for sulfur removal from fuels,” J. Mater. Chem. A. 3 (24) ( 2015) 12738–12747.
[39]         S. D. Khairnar, M. R. Patil, and V. S. Shrivastava, “Hydrothermally synthesized nanocrystalline Nb2O5 and its visible-light photocatalytic activity for the degradation of congo red and methylene blue,” Iran. J. Catal. Hydrothermally. 2 (8) ( 2018) 143–150.
[40]         A. Yousefi and A. NezamzadehEjhieh, “Preparation and characterization of SnO2-BiVO4-CuO catalyst and kinetics of phenazopyridine photodegradation,” Iran. J. Catal. Prep. 11 (3) (2021) 247–259.
[41]         A. F. Abdulrahman, S. M. Ahmed, N. M. Ahmed, and M. A. Almessiere, “Fabrication, characterization of ZnO nanorods on the flexible substrate (Kapton tape) via chemical bath deposition for UV photodetector applications,” AIP Conf. Proc.1875 (2017) 0200041- 0200046.
[42]         A. F. Abdulrahman, S. M. Ahmed, N. M. Ahmed, and M. A. Almessiere, “Different substrates effects on the topography and the structure of the ZnO nanorods grown by chemical bath deposition method,” Dig. J. Nanomater. Biostructures. 11 (3) (2016) 1007–1016.
[43]         F. Zhang, J. Zhao, T. Shen, H. Hidaka, E. Pelizzetti, and N. Serpone, “TiO2-assisted photodegradation of dye pollutants II. Adsorption and degradation kinetics of eosin in TiO2 dispersions under visible light irradiation,” Appl. Catal. B Environ.15 ( 1998) 147–156.
[44]         D. E. Yates, S. Levine, and T. W. Healy, “Site-binding model of the electrical double layer at the oxide/water interface,” J. Chem. Soc. Faraday Trans. 1 Phys. Chem. Condens. Phases. 70 (1974) 1807–1818.
[45]         J. Fernández, J. Kiwi, C. Lizama, J. Freer, J. Baeza, and H. D. Mansilla, “Factorial experimental design of Orange II photocatalytic discolouration,” J. Photochem. Photobiol. A Chem. 151 ( 2002) 213–219.
[46]         L. Nadjia, E. Abdelkader, and B. Ahmed, “Photodegradation study of Congo Red in Aqueous Solution using ZnO/ UV-A: Effect of pH And Band Gap of other Semiconductor Groups,” J. Chem. Eng. Process Technol.02 (02) (2011) 1–7.
[47]         S. Ghattavi and A. Nezamzadeh-Ejhieh, “A brief study on the boosted photocatalytic activity of AgI/WO3/ZnO in the degradation of methylene blue under visible light irradiation,” Desalin. Water Treat. 166 (2019) 92–104.
[48]         M. Mukhopadhyay and D. P. Daswat, “Kinetic and mechanistic study of photochemical degradation of 4-chlorophenol using peroxy acetic acid (PAA),” Desalin. Water Treat. 52  (28–30) (2014) 5704–5714.
[49]         P. Parsoya and S. C. Ameta, “Use of Zinc Ferrite as Photocatalyst for Degradation of Toluidine Blue,” J. Curr. Chem. Pharm. Sci. 6 (4) (2016) 63–69.
[50]         B. Pare, V. Joshi, and S. Piplode, “EFFECT OF OPERATIONAL PARAMETERS ON PHOTOCATALYTIC DEGRADATION OF TOLUIDINE BLUE UTILIZING BiOCl NANOPLATES IN SOLAR LIGHT,” Int. J. Eng. Technol. Manag. Res. 4 (12) ( 2020) 43–54.
[51]         R. Ameta, S. Sharma, S. Sharma, and Y. Gorana, “Visible Light Induced Photocatalytic Degradation of Toluidine Blue-O by using Molybdenum Doped Titanium Dioxide,” Eur. J. Adv. Eng. Technol. 2 (8) ( 2015) 95–99.
[52]         H. Mohammad Salim and S. Mohammad Salih, “Photodegradation Study of Toluidine Blue Dye in Aqueous Solution using Magnesium Oxide as a Photocatalyst,” Int. J. Chem. 7 (2) (2015) 143.
[53]         S. Dhahir, “Removal Color Study of Toluidine Blue dye from Aqueous Solution by using Photo-Fenton Oxidation,” Baghdad Sci. J. 13 (2) ( 2016) 440–446.
[54]         R. Mohammed, S. Ahmed, A. Abdulrahman, and S. Hamad, “Synthesis and Characterizations of ZnO Thin Films Grown by Physical Vapor Deposition Technique,” J. Appl. Sci. Technol. Trends. 1 (4) (2020) 135–139.
[55]         A. F. Abdulrahman, S. M. Ahmed, and M. A. Almessiere, “Effect of the growth time on the optical properties of ZnO nanorods grown by low temperature method,” Dig. J. Nanomater. Biostructures. 12 (4) ( 2017) 1001–1009.
[56]         B. Manikandana, K. R. John, and M. Rita, “Optical, Morphological and Microstructural Investigation of TiO2 nanoparticles for Photocatalytic application,” Iran. J. Catal. 1 (11) ( 2021) 1–11.
[57]         S. Jafari and A. Nezamzadeh-Ejhieh, “Supporting of coupled silver halides onto clinoptilolite nanoparticles as simple method for increasing their photocatalytic activity in heterogeneous photodegradation of mixture of 4-methoxy aniline and 4-chloro-3-nitro aniline,” J. Colloid Interface Sci. 490 (2017) 478–487.
[58]         Z. Khodami and A. Nezamzadeh-Ejhieh, “Investigation of photocatalytic effect of ZnO-SnO2/nano clinoptilolite system in the photodegradation of aqueous mixture of 4-methylbenzoic acid/2-chloro-5-nitrobenzoic acid,” J. Mol. Catal. A Chem. 409 (3) (2015) 59–68.
[59]         A. Habibi-yangjeh and M. Shekofteh-gohari, “Novel magnetic Fe 3 O 4 / ZnO / NiWO 4 nanocomposites : Enhanced visible-light photocatalytic performance through p-n heterojunctions,” Sep. Purif. Technol. 184 ( 2017) 334–346.
[60]         M. Mousavi, A. Habibi-yangjeh, and M. Abitorabi, “Fabrication of novel magnetically separable nanocomposites using graphitic carbon nitride , silver phosphate and silver chloride and their applications in photocatalytic removal of different pollutants using visibl,” J. Colloid Interface Sci. 480 ( 2016) 218–231.
[61]         M. Pirhashemi and A. Habibi-Yangjeh, “Ultrasonic-assisted preparation of plasmonic ZnO/Ag/Ag2WO4 nanocomposites with high visible-light photocatalytic performance for degradation of organic pollutants,” J. Colloid Interface Sci.491 (2016) 216-229.
[62]         H. Dong, G. Chen, J. Sun, C. Li, Y. Hu, and C. Lv, “An advanced Ag-based photocatalyst Ag2Ta4O11 with outstanding activity ,” Phys. Chem. Chem. Phys. 16( 2014) 23915-23921.
[63]         S. Brook, “The absolute energy positions of conduction and valence bands of selected semiconducting minerals,” Am. Mineral. 85 (2000) 543–556.
[64]         L. Dia, H. Yanga, T. Xian, and X. Chen, “Enhanced Photocatalytic Degradation Activity of BiFeO3 Microspheres by Decoration with g-C3 N4 Nanoparticles,” Materials Research.  21 (5) (2018) 1-10.
[65]         P. Ju, P. Wang, B. Li, H. Fan, S. Ai, D. Zhang, and Y. Wang, “A novel calcined Bi2WO6/BiVO4 heterojunction photocatalyst with highly enhanced photocatalytic activity,” Chem. Eng. J. 236 (15) ( 2014) 430–437.
 
Volume 11, Issue 4
December 2021
Pages 405-416
  • Receive Date: 10 October 2021
  • Revise Date: 20 December 2021
  • Accept Date: 26 December 2021
  • First Publish Date: 26 December 2021