A DFT studies on absorbing and sensing possibilities of glucose on graphene surface doped with Ag, Au, Cu, Ni & Pt atoms
The adsorption of glucose is theoretically examined using the Density Functional Theory method (DFT) over pure graphene and graphene surface doped with transition metal atoms (silver, gold, copper, nickel, and platinum). The graphene sheets are altered by substitutional doping of silver, gold, coppe...
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
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Elsevier
2023-05-01
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| Series: | Biosensors and Bioelectronics: X |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2590137022001807 |
| _version_ | 1797868270336868352 |
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| author | Kalpana Devi P K.K. Singh |
| author_facet | Kalpana Devi P K.K. Singh |
| author_sort | Kalpana Devi P |
| collection | DOAJ |
| description | The adsorption of glucose is theoretically examined using the Density Functional Theory method (DFT) over pure graphene and graphene surface doped with transition metal atoms (silver, gold, copper, nickel, and platinum). The graphene sheets are altered by substitutional doping of silver, gold, copper, nickel, and platinum atoms remarks in altering the electronic properties and actively reassuring glucose absorption. The outcomes revealed that metal atoms doped with graphene sheets improve the reactivity. Our study found that the interaction of glucose with pure graphene is weak when compared to metal-doped graphene flakes. Our studies concluded that due to strong adsorption energies, high bandgap variation, and excellent work function values of metal-doped graphene sheets make them beneficial for glucose sensing devices. The sensitivity and conductivity variations are high for the metal doped graphene sheets except nickel, however the recovery time value is high, suggesting that these sheets can be used as a disposable sensor. |
| first_indexed | 2024-04-09T23:53:17Z |
| format | Article |
| id | doaj.art-2e25c37aafc04a6d9026f1ca6f053b42 |
| institution | Directory Open Access Journal |
| issn | 2590-1370 |
| language | English |
| last_indexed | 2024-04-09T23:53:17Z |
| publishDate | 2023-05-01 |
| publisher | Elsevier |
| record_format | Article |
| series | Biosensors and Bioelectronics: X |
| spelling | doaj.art-2e25c37aafc04a6d9026f1ca6f053b422023-03-17T04:33:48ZengElsevierBiosensors and Bioelectronics: X2590-13702023-05-0113100287A DFT studies on absorbing and sensing possibilities of glucose on graphene surface doped with Ag, Au, Cu, Ni & Pt atomsKalpana Devi P0K.K. Singh1Corresponding author.; Department of Physics, Birla Institute of Technology and Science, Pilani -Dubai Campus, Dubai, United Arab EmiratesDepartment of Physics, Birla Institute of Technology and Science, Pilani -Dubai Campus, Dubai, United Arab EmiratesThe adsorption of glucose is theoretically examined using the Density Functional Theory method (DFT) over pure graphene and graphene surface doped with transition metal atoms (silver, gold, copper, nickel, and platinum). The graphene sheets are altered by substitutional doping of silver, gold, copper, nickel, and platinum atoms remarks in altering the electronic properties and actively reassuring glucose absorption. The outcomes revealed that metal atoms doped with graphene sheets improve the reactivity. Our study found that the interaction of glucose with pure graphene is weak when compared to metal-doped graphene flakes. Our studies concluded that due to strong adsorption energies, high bandgap variation, and excellent work function values of metal-doped graphene sheets make them beneficial for glucose sensing devices. The sensitivity and conductivity variations are high for the metal doped graphene sheets except nickel, however the recovery time value is high, suggesting that these sheets can be used as a disposable sensor.http://www.sciencedirect.com/science/article/pii/S2590137022001807Glucose sensorDFT methodGraphene doped with transition metalsElectronic calculationsWork function sensorCharge transfer |
| spellingShingle | Kalpana Devi P K.K. Singh A DFT studies on absorbing and sensing possibilities of glucose on graphene surface doped with Ag, Au, Cu, Ni & Pt atoms Biosensors and Bioelectronics: X Glucose sensor DFT method Graphene doped with transition metals Electronic calculations Work function sensor Charge transfer |
| title | A DFT studies on absorbing and sensing possibilities of glucose on graphene surface doped with Ag, Au, Cu, Ni & Pt atoms |
| title_full | A DFT studies on absorbing and sensing possibilities of glucose on graphene surface doped with Ag, Au, Cu, Ni & Pt atoms |
| title_fullStr | A DFT studies on absorbing and sensing possibilities of glucose on graphene surface doped with Ag, Au, Cu, Ni & Pt atoms |
| title_full_unstemmed | A DFT studies on absorbing and sensing possibilities of glucose on graphene surface doped with Ag, Au, Cu, Ni & Pt atoms |
| title_short | A DFT studies on absorbing and sensing possibilities of glucose on graphene surface doped with Ag, Au, Cu, Ni & Pt atoms |
| title_sort | dft studies on absorbing and sensing possibilities of glucose on graphene surface doped with ag au cu ni amp pt atoms |
| topic | Glucose sensor DFT method Graphene doped with transition metals Electronic calculations Work function sensor Charge transfer |
| url | http://www.sciencedirect.com/science/article/pii/S2590137022001807 |
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