Skip to main content
SpringerLink
Log in

A density functional theory investigation on the Ag-decorated boron nitride nanosheet as an isoniazid drug sensor

  • Original Paper
  • Published:
Monatshefte für Chemie - Chemical Monthly Aims and scope Submit manuscript

Abstract

We employed density functional B3LYP to inspect the impact of Ag-decoration on a BN nanosheet sensing performance in detection of isoniazid drug. The interaction of the pristine BN nanosheet with isoniazid was found to be weak, and the sensing response is about 2.4. Decorating an Ag atom into the BN nanosheet surface increases the adsorption energy of isoniazid from − 17.6 to − 95.7 kJ/mol. The sensing response significantly rises to 79.1 by Ag-decoration. A short recovery time of 4.9 s is found for the isoniazid desorption from the Ag-decorated BN nanosheet surface at 298 K. The water solvent reduces adsorption energy of isoniazid to − 77.3 kJ/mol. Finally, we found that Ag-decorated BN nanosheet may be promising and highly sensitive isoniazid sensor.

Graphical abstract

This is a preview of subscription content, log in via an institution to check access.

Access this article

Log in via an institution

Price excludes VAT (USA)
Tax calculation will be finalised during checkout.

Instant access to the full article PDF.

Institutional subscriptions

Fig. 1
Fig. 2
Fig. 3
Fig. 4
Fig. 5
Fig. 6
Fig. 7

Similar content being viewed by others

References

  1. Naso E, Calo LA (2021) Acta Medica Mediterr. 37:21. https://doi.org/10.19193/0393-6384_2021_1_1

    Article  Google Scholar 

  2. Gelzo M, Caputo M, Comegna M, Cernera G, Di Minno A, Scialo F, Castaldo G, Corso G (2021) Acta Medica Mediterr 37:35. https://doi.org/10.19193/0393-6384_2021_1_3

    Article  Google Scholar 

  3. Geyik G, Sahin A, Pekcioglu Y, Okuroglu N, Doganay L, Ozdil K (2021) Acta Medica Mediterr 37:43. https://doi.org/10.19193/0393-6384_2021_1_4

    Article  Google Scholar 

  4. Yuan SM (2021) Acta Medica Mediterr. 37:51. https://doi.org/10.19193/0393-6384_2021_1_5

    Article  Google Scholar 

  5. Moon YE, Kim JY, Lee SY, Kim J, Joo MA, Park HJ (2021) Acta Medica Mediterr 37:69. https://doi.org/10.19193/0393-6384_2021_1_8

    Article  Google Scholar 

  6. Jin RY, Hu SQ, Zhang YH (2008) Chin Chem Lett 19:1375

    CAS  Google Scholar 

  7. Hu K, Wang F, Shen Z, Liu H, Xiong J (2021) J Alloys Compd 850:156663

    CAS  Google Scholar 

  8. Jiang Q, Jiang Q, Jin S, Jin S, Jiang Y, Jiang Y, Hao J (2017) Mol Neurobiol 54:594

    CAS  PubMed  Google Scholar 

  9. Zou Q, Xing P, Wei L, Liu B (2019) RNA (Cambridge) 25:205

    CAS  Google Scholar 

  10. Huang Q, Mao M, An L, Li Y, Zhang X, Fu L, Lang T, Wang Z, Nie Y, Wang X (2021) Acta Medica Mediterr 37:81-86. https://doi.org/10.19193/0393-6384_2021_1_10

    Article  Google Scholar 

  11. Yu Y, Zhao Y, Qiao Y, Feng Y, Li W, Fei W (2021) J Mater Sci Technol 84:10

    Google Scholar 

  12. Zhang X, Sun X, Lv T, Weng L, Chi M, Shi J, Zhang S (2020) J Mater Sci Mater 31:13344

    CAS  Google Scholar 

  13. Wang P, Wang S, Kang Y, Sun Z, Wang X, Meng Y, Xie W (2021) J Alloys Compd 854:157152

    CAS  Google Scholar 

  14. Tang X, Wu J, Wu W, Zhang Z, Zhang W, Zhang Q, Li P (2020) Anal Chem 92:3563

    CAS  PubMed  Google Scholar 

  15. Cheng Z, Luo C, Guo Z (2021) Acta Medica Mediterr 37:87. https://doi.org/10.19193/0393-6384_2021_1_11

    Article  CAS  Google Scholar 

  16. Yinfei M, Li W, Hamreh S (2020) Monatsh Chem 151:1039

    Google Scholar 

  17. Zhang J, Kong Q, Zhou Z, Liu P (2021) Monatsh Chem 152:481

    CAS  Google Scholar 

  18. Moghaddaszadeh Z, Toosi MR, Zardoost MR, Arabieh M (2020) Monatsh Chem 151:1501

    CAS  Google Scholar 

  19. Ahmadi S, Hosseinian A, Kheirollahi Nezhad PD, Monfared A, Vessally E (2019) Iran J Chem Chem Eng 38:1

    CAS  Google Scholar 

  20. Vessally E, Mohammadi S, Abdoli M, Hosseinian A, Ojaghloo P (2020) Iran J Chem Chem Eng 39:11

    CAS  Google Scholar 

  21. Gharibzadeh F, Vessally E, Edjlali L, Es’haghi M, Mohammadi R (2020) Iran J Chem Chem Eng 39:51

    Google Scholar 

  22. Vessally E, Babazadeh M, Alipour F, Hosseinian A, Kheirollahi Nezhad PD (2021) Iran J Chem Chem Eng 40:691

    Google Scholar 

  23. Vessally E, Farajzadeh P, Najafi E (2021) Iran J Chem Chem Eng 40:1001

    CAS  Google Scholar 

  24. Ma X, Kexin Z, Yonggang W, Ebadi AG, Toughani M (2021) Iran J Chem Chem Eng 40:1364

    Google Scholar 

  25. Sun Y, Chen C, Xiong Y, Tan C, Liu Y, Li R (2021) Acta Medica Mediterr. 37:105. https://doi.org/10.19193/0393-6384_2021_1_14

    Article  Google Scholar 

  26. Miao R, Li X, Lei Q, Liu H, Ma Z, Liu X, Yin Z, Tang Z, Zhang L, Tian Y (2021). Rare Met. https://doi.org/10.1007/s12598-021-01854-6

    Article  Google Scholar 

  27. Liu L, Zhang X, Zhu Q, Li K, Lu Y, Zhou X, Guo T (2021) Light Sci Appl 10:181

    CAS  PubMed  PubMed Central  Google Scholar 

  28. Zhang X, Tang Y, Zhang F, Lee C (2016) Adv Energy Mater 6:1502588

    Google Scholar 

  29. Ahmadi Peyghan A, Hadipour NL, Bagheri Z (2013) J Phys Chem C 117:2427

    CAS  Google Scholar 

  30. Tang W, Wan S, Yang Z, Teschendorff AE, Zou Q, Sahinalp C (2018) Bioinform 34:398

    CAS  Google Scholar 

  31. Beheshtian J, Baei MT, Peyghan AA, Bagheri Z (2013) J Mol Model 19:943

    CAS  PubMed  Google Scholar 

  32. Hashemzadeh B, Edjlali L, Kheirollahi Nezhad PD, Vessally E (2021). Chem Rev Lett. https://doi.org/10.22034/crl.2020.187273.1087

    Article  Google Scholar 

  33. Salehi N, Vessally E, Edjlali L, Alkorta I, Eshaghi M (2020) Chem Rev Lett 3:207

    CAS  Google Scholar 

  34. Sreerama L, Vessally E, Behmagham F (2020) J Chem Lett 1:9

    Google Scholar 

  35. Majedi S, Sreerama L, Vessally E, Behmagham F (2020) J Chem Lett 1:25

    Google Scholar 

  36. Liu H, Chen F (2021) Acta Medica Mediterr 37:111. https://doi.org/10.19193/0393-6384_2021_1_15

    Article  CAS  Google Scholar 

  37. Balasubramanian C, Bellucci S, Castrucci P, de Crescenzi M, Bhoraskar SV (2004) Chem Phys Lett 383:188

    CAS  Google Scholar 

  38. Zou Y, Wu H, Guo X, Peng L, Ding Y, Tang J, Guo F (2021) Current Bioinformatics 16:274-283. https://doi.org/10.2174/1574893615999200607173829

    Article  CAS  Google Scholar 

  39. Wang Q, Sun Q, Jena P, Kawazoe Y (2009) ACS Nano 3:621

    CAS  PubMed  Google Scholar 

  40. Engstrom O (2013) Monatsh Chem 144:73

    CAS  Google Scholar 

  41. Baei MT (2012) Monatsh Chem 143:545

    CAS  Google Scholar 

  42. Mirzaei M, Mirzaei M (2011) Monatsh Chem 142:115

    CAS  Google Scholar 

  43. Cen F, Zhu T, Lin Z (2021) Acta Medica Mediterr 37:99. https://doi.org/10.19193/0393-6384_2021_1_13

    Article  Google Scholar 

  44. Koao LF, Hone FG, Dejene FB (2020) J Nanostruct Chem 10:1

    CAS  Google Scholar 

  45. Aragaw BA (2020) J Nanostruct Chem 10:9

    CAS  Google Scholar 

  46. Malinga NN, Jarvis ALL (2020) J Nanostruct Chem 10:55

    CAS  Google Scholar 

  47. Rezaei A, Ghiasi R, Marjani A (2020) J Nanostruct Chem 10:179

    Google Scholar 

  48. Najafi F (2020) J Nanostruct Chem 10:227

    CAS  Google Scholar 

  49. Foroutan M, Fatemi SJ, Fatemi SM (2020) J Nanostruct Chem 10:265

    CAS  Google Scholar 

  50. Ahmadi A, Hadipour NL, Kamifiroozi M, Bagheri Z (2012) Sens Actuators B Chem 161:1025

    CAS  Google Scholar 

  51. Ahmadi Peyghan A, Omidvar A, Hadipour NL, Bagheri Z, Kamfiroozi M (2012) Physica E 44:1357

    Google Scholar 

  52. Li SS (2012) Nonholonomic motion planning. Springer Science & Business Media

  53. Stegmeier S, Fleischer M, Hauptmann P (2010) Sens Actuators B Chem 148:439

    CAS  Google Scholar 

  54. Hussain T, Hankel M, Searles DJ (2017) J Phys Chem C 121:24365

    CAS  Google Scholar 

  55. Hussain T, Vovusha H, Umer R, Ahuja R (2018) Appl Surf Sci 456:711

    CAS  Google Scholar 

  56. Islam MS, Hussain T, Rao G, Panigrahi P, Ahuja R (2016) Sens Actuators B Chem 228:317

    CAS  Google Scholar 

  57. Hussain T, Kaewmaraya T, Khan M, Chakraborty S, Islam MS, Amornkitbamrung V, Ahuja R (2017) Nanotechnology 28:415502

    PubMed  Google Scholar 

  58. Sagynbaeva M, Hussain T, Panigrahi P, Johansson B, Ahuja R (2015) Europhys Lett 109:57008

    Google Scholar 

  59. Tusche C, Meyerheim H, Kirschner J (2007) Phys Rev Lett 99:026102

    CAS  PubMed  Google Scholar 

  60. Ivanova MN, Grayfer ED, Plotnikova EE, Kibis LS, Darabdhara G, Boruah PK, Das MR, Fedorov VE (2019) ACS Appl Mater Interfaces 11:22102

    CAS  PubMed  Google Scholar 

  61. Ghanbari R, Safaiee R, Golshan MM (2018) Appl Surf Sci 457:303

    CAS  Google Scholar 

  62. Guo Y, Zhang Y, Wu W, Liu Y, Zhou Z (2018) Appl Surf Sci 455:106

    CAS  Google Scholar 

  63. Zhang X, Huang R, Gui Y, Zeng H (2016) Sensors 16:1830

    PubMed Central  Google Scholar 

  64. Harun Achmad M, Al Sarraf AAM, Bokov DO, Raya I, Derakhshandeh M (2021) Inorg Chem Commun 133:108892

    CAS  Google Scholar 

  65. Ravaei I, Haghighat M, Azami SM (2019) Appl Surf Sci 469:103

    CAS  Google Scholar 

  66. Saikia N, Deka RC (2013) J Mol Model 19:215

    CAS  PubMed  Google Scholar 

  67. Bano A, Krishna J, Pandey DK, Gaur N (2019) Phys Chem Chem Phys 21:4633

    CAS  PubMed  Google Scholar 

  68. Cossi M, Barone V, Cammi R, Tomasi J (1996) Chem Phys Lett 255:327

    CAS  Google Scholar 

  69. Akbari F, Reisi-Vanani A, Darvishnejad MH (2019) Appl Surf Sci 488:600

    CAS  Google Scholar 

  70. O’boyle NM, Tenderholt AL, Langner KM (2008) J Comput Chem 29:839

    PubMed  Google Scholar 

  71. Baei MT, Peyghan AA, Bagheri Z, Tabar MB (2012) Phys Lett A 377:107

    CAS  Google Scholar 

  72. Adhikari K, Ray A (2011) Phys Lett A 375:1817

    CAS  Google Scholar 

  73. Zhao G, Li X, Huang M, Zhen Z, Zhong Y, Chen Q, Zhao X, He Y, Hu R, Yang T (2017) Chem Soc Rev 46:4417

    CAS  PubMed  Google Scholar 

  74. Rodrigues BS, Almeida VA, Claudino CH, Ponce-de-Leon C, Bavykin DV, Souza JS (2020) J Nanostruct Chem 10:363

    CAS  Google Scholar 

  75. Moradi O, Zare K, Monajjemi M, Yari M, Aghaie H (2010) Fullerenes, Nanotubes. Carbon Nanostruct 18:285

    CAS  Google Scholar 

  76. Moradi O, Zare K (2011) Fullerenes, Nanotubes, Carbon Nanostruct 19:628

    CAS  Google Scholar 

  77. Moradi O, Zare K (2013) Fullerenes, Nanotubes Carbon Nanostruct 21:449

    CAS  Google Scholar 

Download references

Author information

Authors and Affiliations

  1. School of Environmental and Quality Inspection, Chongqing Chemical Industry Vocational College, Chongqing, 401220, China

    Yuhua Han, Wenli Li & Chunyu Song

  2. Chongqing Institute for Food and Drug Control, Chongqing, 401120, China

    Yanlei Wu

  3. Department of Chemistry, Tabriz University, Tabriz, Iran

    Fatemeh Ahmadi Peyghan

Authors
  1. Yuhua Han
    View author publications

    You can also search for this author in PubMed Google Scholar

  2. Wenli Li
    View author publications

    You can also search for this author in PubMed Google Scholar

  3. Chunyu Song
    View author publications

    You can also search for this author in PubMed Google Scholar

  4. Yanlei Wu
    View author publications

    You can also search for this author in PubMed Google Scholar

  5. Fatemeh Ahmadi Peyghan
    View author publications

    You can also search for this author in PubMed Google Scholar

Corresponding author

Correspondence to Wenli Li.

Additional information

Publisher's Note

Springer Nature remains neutral with regard to jurisdictional claims in published maps and institutional affiliations.

Rights and permissions

Reprints and permissions

About this article

Check for updates. Verify currency and authenticity via CrossMark

Cite this article

Han, Y., Li, W., Song, C. et al. A density functional theory investigation on the Ag-decorated boron nitride nanosheet as an isoniazid drug sensor. Monatsh Chem 153, 153–160 (2022). https://doi.org/10.1007/s00706-021-02882-9

Download citation

  • Received:

  • Accepted:

  • Published:

  • Issue Date:

  • DOI: https://doi.org/10.1007/s00706-021-02882-9

Keywords

Search

Navigation