THEORETICAL STUDY OF MOLYBDENUM CHEMISORPTION ON Si (111) AND Si(100) SURFACES
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Abstract
The chemisorptions of Mo on both Si(111) and Si(100) surfaces are investigated by the DV-Xα-SCF method. The results show that after overcoming a certain energy barrier the adsorbate Mo can penetrate the surface to form adamantine structure. The electronic states of chemisorption are calculated and compared with experimental results.
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TANG Shaoping, ZHANG Kaiming, XIE Xide. THEORETICAL STUDY OF MOLYBDENUM CHEMISORPTION ON Si (111) AND Si(100) SURFACES[J]. Chin. Phys. Lett., 1988, 5(1): 29-32.
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TANG Shaoping, ZHANG Kaiming, XIE Xide. THEORETICAL STUDY OF MOLYBDENUM CHEMISORPTION ON Si (111) AND Si(100) SURFACES[J]. Chin. Phys. Lett., 1988, 5(1): 29-32.
|
TANG Shaoping, ZHANG Kaiming, XIE Xide. THEORETICAL STUDY OF MOLYBDENUM CHEMISORPTION ON Si (111) AND Si(100) SURFACES[J]. Chin. Phys. Lett., 1988, 5(1): 29-32.
|
TANG Shaoping, ZHANG Kaiming, XIE Xide. THEORETICAL STUDY OF MOLYBDENUM CHEMISORPTION ON Si (111) AND Si(100) SURFACES[J]. Chin. Phys. Lett., 1988, 5(1): 29-32.
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