2002
DOI: 10.1103/physrevb.65.075318
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Hydrogen adsorption on phosphorus-rich(2×1)indium phosphide (001)

Abstract: Hydrogen adsorption on the InP (001)-(2ϫ1) reconstruction has been characterized by vibrational spectroscopy and ab initio calculations with density functional theory. The (2ϫ1) surface is covered with a complete layer of phosphorus dimers. The clean and hydrogen-terminated dimers have been modeled by In 5 P 4 H x clusters with the proper number of covalent and dative bonds to accurately represent the surface of interest. The optimized molecular cluster of the unreacted dimer reveals that it has one filled and… Show more

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Cited by 29 publications
(21 citation statements)
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“…The assignment of the two peaks is also supported by a cluster calculation published earlier by the Hicks group. 14 We attribute three positive peaks to metastable transition states ͑atomic structures͒ that are being formed upon exposure to atomic hydrogen. In the absence of further side reactions the latter peaks should disappear upon further exposure to atomic hydrogen with only the two expected positive peaks remaining.…”
Section: Resultsmentioning
confidence: 99%
“…The assignment of the two peaks is also supported by a cluster calculation published earlier by the Hicks group. 14 We attribute three positive peaks to metastable transition states ͑atomic structures͒ that are being formed upon exposure to atomic hydrogen. In the absence of further side reactions the latter peaks should disappear upon further exposure to atomic hydrogen with only the two expected positive peaks remaining.…”
Section: Resultsmentioning
confidence: 99%
“…Such di-hydride complexes could be found both in cation vacancies and at internal surfaces. 27,28 At the same time, this di-hydride dipole could be isotropically oriented, with equal contributions along all axes ͑x , y , z͒, because it is not located on a particular surface.…”
Section: Discussionmentioning
confidence: 99%
“…[33][34][35][36][37][38][39][40] and Table III. [41][42][43][44] The most intense peaks are marked with a star symbol. The multiphonon vibrations of InP are present at 720 cm )1 , 742 cm )1 , 777 cm )1 , 808 cm )1 , 840 cm )1 , 937 cm )1 , 963 cm )1 , 998 cm )1 , and 1,025 cm )1 , within the entire spectral region from 700 cm )1 to 4,000 cm )1 .…”
Section: Methodsmentioning
confidence: 99%
“…The intensity of the peak at 2,312 cm )1 was the same in both the p-and s-polarized spectra, indicating that the P-H stretch mode has a preferred in-plane orientation. 44 Additionally, there was no Ga or As-related hydride peaks observed. The H-related peaks, not shown, exhibit a similar behavior for all of the samples including samples 1-3.…”
Section: Oxide and Hydride Formationmentioning
confidence: 97%
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