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Sadhukhan, Banasree, Singh, Prashant, Nayak, Arabinda, Datta, Sujoy, Johnson, Duane D., Mookerjee, Abhijit (2017) Band-gap tuning and optical response of two-dimensionalSixC1−x: A first-principles real-space study of disordered two-dimensional materials. Physical Review B, 96 (5) doi:10.1103/physrevb.96.054203

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Reference TypeJournal (article/letter/editorial)
TitleBand-gap tuning and optical response of two-dimensionalSixC1−x: A first-principles real-space study of disordered two-dimensional materials
JournalPhysical Review B
AuthorsSadhukhan, BanasreeAuthor
Singh, PrashantAuthor
Nayak, ArabindaAuthor
Datta, SujoyAuthor
Johnson, Duane D.Author
Mookerjee, AbhijitAuthor
Year2017 (August 9)Volume96
Issue5
PublisherAmerican Physical Society (APS)
DOIdoi:10.1103/physrevb.96.054203Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID14249945Long-form Identifiermindat:1:5:14249945:2
GUID0
Full ReferenceSadhukhan, Banasree, Singh, Prashant, Nayak, Arabinda, Datta, Sujoy, Johnson, Duane D., Mookerjee, Abhijit (2017) Band-gap tuning and optical response of two-dimensionalSixC1−x: A first-principles real-space study of disordered two-dimensional materials. Physical Review B, 96 (5) doi:10.1103/physrevb.96.054203
Plain TextSadhukhan, Banasree, Singh, Prashant, Nayak, Arabinda, Datta, Sujoy, Johnson, Duane D., Mookerjee, Abhijit (2017) Band-gap tuning and optical response of two-dimensionalSixC1−x: A first-principles real-space study of disordered two-dimensional materials. Physical Review B, 96 (5) doi:10.1103/physrevb.96.054203
In(2017, August) Physical Review B Vol. 96 (5) American Physical Society (APS)

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Sadhukhan, Banasree, Bandyopadhyay, Subhadeep, Nayak, Arabinda, Mookerjee, Abhijit (2017) Disorder induced lifetime effects in binary disordered systems: A first principles formalism and an application to disordered graphene. International Journal of Modern Physics B, 31 (29). 1750218pp. doi:10.1142/s0217979217502186
Sadhukhan, Banasree, Nayak, Arabinda, Mookerjee, Abhijit (2017) Effect of disorder on the optical response of NiPt and Ni3Pt alloys. Computational Materials Science, 140. 1-9 doi:10.1016/j.commatsci.2017.08.003
Datta, Sujoy, Singh, Prashant, Chaudhuri, Chhanda B, Jana, Debnarayan, Harbola, Manoj K, Johnson, Duane D, Mookerjee, Abhijit (2019) Simple correction to bandgap problems in IV and III–V semiconductors: an improved, local first-principles density functional theory. Journal of Physics: Condensed Matter, 31 (49). 495502pp. doi:10.1088/1361-648x/ab34ad
Datta, Sujoy, Singh, Prashant, Jana, Debnarayan, Chaudhuri, Chhanda B., Harbola, Manoj K., Johnson, Duane D., Mookerjee, Abhijit (2020) Exploring the role of electronic structure on photo-catalytic behavior of carbon-nitride polymorphs. Carbon, 168. 125-134 doi:10.1016/j.carbon.2020.04.008
Singh, Prashant, Harbola, Manoj K., Hemanadhan, M., Mookerjee, Abhijit, Johnson, D. D. (2016) Better band gaps with asymptotically corrected local exchange potentials. Physical Review B, 93 (8) doi:10.1103/physrevb.93.085204
Singh, Prashant, Harbola, Manoj K., Sanyal, Biplab, Mookerjee, Abhijit (2013) Accurate determination of band gaps within density functional formalism. Physical Review B, 87 (23) doi:10.1103/physrevb.87.235110
Alam, Aftab, Chouhan, Rajiv Kumar, Mookerjee, Abhijit (2011) Phonon modes and vibrational entropy of disordered alloys with short-range order: A first-principles calculation. Physical Review B, 83 (5) doi:10.1103/physrevb.83.054201
Alam, Aftab, Ghosh, Subhradip, Mookerjee, Abhijit (2007) Phonons in disordered alloys: Comparison between augmented-space-based approximations for configuration averaging to integration from first principles. Physical Review B, 75 (13) doi:10.1103/physrevb.75.134202
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Matthes, Lars, Pulci, Olivia, Bechstedt, Friedhelm (2016) Influence of out-of-plane response on optical properties of two-dimensional materials: First principles approach. Physical Review B, 94 (20) doi:10.1103/physrevb.94.205408
Wu, Feng, Smart, Tyler J., Xu, Junqing, Ping, Yuan (2019) Carrier recombination mechanism at defects in wide band gap two-dimensional materials from first principles. Physical Review B, 100 (8) doi:10.1103/physrevb.100.081407
 
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