Fe-substituted indium thiospinels: New intermediate band semiconductors with better absorption of solar energy

被引:27
作者
Chen, Ping [1 ]
Chen, Haijie [1 ]
Qin, Mingsheng [1 ]
Yang, Chongyin [1 ]
Zhao, Wei [1 ]
Liu, Yufeng [1 ]
Zhang, Wenqing [1 ]
Huang, Fuqiang [1 ,2 ,3 ]
机构
[1] Chinese Acad Sci, Shanghai Inst Ceram, CAS Key Lab Mat Energy Convers, Shanghai 200050, Peoples R China
[2] Peking Univ, Coll Chem & Mol Engn, Beijing Natl Lab Mol Sci, Beijing 100871, Peoples R China
[3] Peking Univ, Coll Chem & Mol Engn, State Key Lab Rare Earth Mat Chem & Applicat, Beijing 100871, Peoples R China
关键词
ELECTRONIC-STRUCTURE; EFFICIENCY; IN2S3; CELLS; PHOTOVOLTAICS; POWDER; ALLOYS;
D O I
10.1063/1.4808352
中图分类号
O59 [应用物理学];
学科分类号
摘要
The indium thiospinels In2S3 and MgIn2S4 are promising host for the intermediated band (IB) photovoltaic materials due to their ideal band gap value. Here, the optical properties and electronic structure of Fe-doped In2S3 and MgIn2S4 have been investigated. All the Fe-substituted semiconductors exhibit two additional absorption bands at about 0.7 and 1.25 eV, respectively. The results of first-principles calculations revealed that the Fe substituted at the octahedral In site would introduce a partially filled IB into the band gap. Thanks to the formation of IB, the Fe-substituted semiconductors have the ability to absorb the photons with energies below the band gap. With the wide-spectrum absorption of solar energy, these materials possess potential applications in photovoltaic domain. (C) 2013 AIP Publishing LLC.
引用
收藏
页数:8
相关论文
共 72 条
[41]   First-principles investigation of isolated band formation in half-metallic TixGa1-xP (x=0.3125-0.25) -: art. no. 085206 [J].
Palacios, P ;
Fernández, JJ ;
Sánchez, K ;
Conesa, JC ;
Wahnón, P .
PHYSICAL REVIEW B, 2006, 73 (08)
[42]   Transition-metal-substituted indium thiospinels as novel intermediate-band materials:: Prediction and understanding of their electronic properties [J].
Palacios, P. ;
Aguilera, I. ;
Sanchez, K. ;
Conesa, J. C. ;
Wahnon, P. .
PHYSICAL REVIEW LETTERS, 2008, 101 (04)
[43]  
Qin M. S., 2012, APPL MECH MAT, V148-149, P1558, DOI DOI 10.4028/WWW.SCIENTIFIC.NET/AMM.148-149.1558
[44]   Rietveld refinement of In2S3 using neutron and X-ray powder diffraction data [J].
Rampersadh, Niyum S. ;
Venter, Andrew M. ;
Billing, David G. .
PHYSICA B-CONDENSED MATTER, 2004, 350 (1-3) :E383-E385
[45]   Formation of a reliable intermediate band in Si heavily coimplanted with chalcogens (S, Se, Te) and group III elements (B, Al) [J].
Sanchez, K. ;
Aguilera, I. ;
Palacios, P. ;
Wahnon, P. .
PHYSICAL REVIEW B, 2010, 82 (16)
[46]   Assessment through first-principles calculations of an intermediate-band photovoltaic material based on Ti-implanted silicon: Interstitial versus substitutional origin [J].
Sanchez, K. ;
Aguilera, I. ;
Palacios, P. ;
Wahnon, P. .
PHYSICAL REVIEW B, 2009, 79 (16)
[47]   Structural and optical studies on thermal-annealed In2S3 films prepared by the chemical bath deposition technique [J].
Sandoval-Paz, MG ;
Sotelo-Lerma, M ;
Valenzuela-Jáuregui, JJ ;
Flores-Acosta, M ;
Ramírez-Bon, R .
THIN SOLID FILMS, 2005, 472 (1-2) :5-10
[48]   Band anticrossing in GaInNAs alloys [J].
Shan, W ;
Walukiewicz, W ;
Ager, JW ;
Haller, EE ;
Geisz, JF ;
Friedman, DJ ;
Olson, JM ;
Kurtz, SR .
PHYSICAL REVIEW LETTERS, 1999, 82 (06) :1221-1224
[49]   REVISED EFFECTIVE IONIC-RADII AND SYSTEMATIC STUDIES OF INTERATOMIC DISTANCES IN HALIDES AND CHALCOGENIDES [J].
SHANNON, RD .
ACTA CRYSTALLOGRAPHICA SECTION A, 1976, 32 (SEP1) :751-767
[50]   DETAILED BALANCE LIMIT OF EFFICIENCY OF P-N JUNCTION SOLAR CELLS [J].
SHOCKLEY, W ;
QUEISSER, HJ .
JOURNAL OF APPLIED PHYSICS, 1961, 32 (03) :510-&