2013
DOI: 10.1103/physrevb.88.085202
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Microscopic origin ofn-type behavior in Si-doped AlN

Abstract: In contrast to a long held belief, it has been shown that n-type AlN can be achieved through Si-doping. This is unexplainable from the current theoretical understanding, a situation that hinders further progress in AlN-based ultraviolet (UV) technologies. From first-principles calculations, we find that n-type behavior arises under N-rich growth conditions due to high Si solubility and to the formation of V Al-bound Si clusters. We show that metal-rich growth may lead to weak n-type behavior due to oxygen impu… Show more

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Cited by 23 publications
(24 citation statements)
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References 33 publications
(55 reference statements)
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“…A more recent calculation predicted no DX-like behavior for Si in AlN and suggested that the n-type conductivity in AlN is caused by the cluster of four Si and an Al vacancy, V Al -4Si, which is predicted to have a formation energy lower than that of the substitutional Si Al donor. 12 In a Raman spectroscopy study of GaN:Si under hydrostatic pressure, where the results can be transferred to Al x Ga 1Àx N, no DX behavior was detected for x up to $0.56. 13 A later transport study 14 suggested Si to be a DX center in Al x Ga 1Àx N for x !…”
Section: Stable and Metastable Si Negative-u Centers In Algan And Alnmentioning
confidence: 99%
“…A more recent calculation predicted no DX-like behavior for Si in AlN and suggested that the n-type conductivity in AlN is caused by the cluster of four Si and an Al vacancy, V Al -4Si, which is predicted to have a formation energy lower than that of the substitutional Si Al donor. 12 In a Raman spectroscopy study of GaN:Si under hydrostatic pressure, where the results can be transferred to Al x Ga 1Àx N, no DX behavior was detected for x up to $0.56. 13 A later transport study 14 suggested Si to be a DX center in Al x Ga 1Àx N for x !…”
Section: Stable and Metastable Si Negative-u Centers In Algan And Alnmentioning
confidence: 99%
“…22 The deep acceptor is most likely a triply charged cation vacancy (V III ) 3À . 6,21 The appearance of the deep acceptor and the increase in resistivity from sample B to sample C, despite an increase in the Si concentration, indicate that for the highest SiH 4 flux the sample is in the selfcompensating regime.…”
mentioning
confidence: 99%
“…Alternatively, oxygen on an interstitial site (O À i ) would act as a singly charged acceptor. 21 The low energy impurity transition at either 3.39 eV or 3.36 eV is attributed to recombination between a shallow donor (Si) and a doubly charged deep level acceptor. The doubly charged deep level acceptor is most likely an acceptor complex (V III -O N ) 2À .…”
mentioning
confidence: 99%
“…photoelectron spectroscopy (XPS) investigation has confirmed that Si exist as Si 4+ and Al exist as Al 3+ in these examined thin films. Substituting Al 3+ with Si 4+ will consequently generate point defects (Si Al and aluminum vacancy (V Al ′)) to maintain charge neutrality 29 . In order to confirm the presence of point defects, several thin films were subjected to Raman measurements and the results are presented in Fig.…”
Section: Elucidation On Mechanism Of Polarity Inversion -Effect Of Simentioning
confidence: 99%
“…The excess of Mg will form Mg x Al 1−x N as well as V N and their coexistence has been proven to result in thin film with Al-polarity 39 . Meanwhile, the presence of smaller amount of N-polar components is believed to correspond with the existence of Si x Al 1−x N as a product from the excess of Si, whose formation could induce defect cluster of [V Al + nSi Al ] 29 that lead to polarity inversion. Since the excess of Si exist in smaller amount, the polarity inversion also occurs locally.…”
Section: Effect Of Mgsi Addition On Polarity Inversion Incorporatingmentioning
confidence: 99%