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Singh, D. J. (2008) Electronic structure and doping inBaFe2As2and LiFeAs: Density functional calculations. Physical Review B, 78 (9) doi:10.1103/physrevb.78.094511

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Reference TypeJournal (article/letter/editorial)
TitleElectronic structure and doping inBaFe2As2and LiFeAs: Density functional calculations
JournalPhysical Review B
AuthorsSingh, D. J.Author
Year2008 (September 17)Volume78
Issue9
PublisherAmerican Physical Society (APS)
DOIdoi:10.1103/physrevb.78.094511Search in ResearchGate
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Mindat Ref. ID14200037Long-form Identifiermindat:1:5:14200037:5
GUID0
Full ReferenceSingh, D. J. (2008) Electronic structure and doping inBaFe2As2and LiFeAs: Density functional calculations. Physical Review B, 78 (9) doi:10.1103/physrevb.78.094511
Plain TextSingh, D. J. (2008) Electronic structure and doping inBaFe2As2and LiFeAs: Density functional calculations. Physical Review B, 78 (9) doi:10.1103/physrevb.78.094511
In(2008, September) Physical Review B Vol. 78 (9) American Physical Society (APS)

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Singh, D. J., Gupta, M. (2007) Anomalous structural behavior and electronic structure inZrBe2Hx: Density functional calculations. Physical Review B, 76 (7) doi:10.1103/physrevb.76.075120
Subedi, Alaska, Singh, David J. (2008) Density functional study ofBaNi2As2: Electronic structure, phonons, and electron-phonon superconductivity. Physical Review B, 78 (13) doi:10.1103/physrevb.78.132511
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Kagimura, R., Suewattana, M., Singh, D. J. (2008) (Ba,K,La)ZrO3as a possible lead-free ferroelectric: Density functional calculations. Physical Review B, 78 (1) doi:10.1103/physrevb.78.012103
Singh, David J. (2010) Electronic structure calculations with the Tran-Blaha modified Becke-Johnson density functional. Physical Review B, 82 (20) doi:10.1103/physrevb.82.205102
Gupta, M., Singh, D. J., Gupta, R. (2005) Origin of the 20-electron structure ofMg3MnH7: Density functional calculations. Physical Review B, 71 (9) doi:10.1103/physrevb.71.092107
Biswas, Koushik, Du, Mao-Hua, Singh, David J. (2012) Electronic structure and defect properties of Tl6SeI4: Density functional calculations. Physical Review B, 86 (14) doi:10.1103/physrevb.86.144108
Subedi, Alaska, Singh, David J. (2008) Bonding in Zintl phase hydrides: Density functional calculations for SrAlSiH,SrAl2H2,SrGa2H2, andBaGa2H2. Physical Review B, 78 (4) doi:10.1103/physrevb.78.045106
Johannes, M. D., Singh, D. J. (2005) Crystal structure and electric field gradients ofPbZrO3from density functional calculations. Physical Review B, 71 (21) doi:10.1103/physrevb.71.212101
 
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