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Small Al clusters on the Cu(111) surface: Atomic relaxation and vibrational properties

โœ Scribed by G. G. Rusina; S. D. Borisova; E. V. Chulkov

Book ID
110185133
Publisher
International Academic Publishing Co (Nauka/Interperiodica)
Year
2010
Tongue
English
Weight
359 KB
Volume
84
Category
Article
ISSN
0036-0244

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The optimized geometries and computed vibrational frequencies for ลฝ . CH O adsorbed at fcc and hcp threefold sites were determined for the Al 111 and 3 ลฝ . Cu 111 surfaces using cluster calculations. The frequencies of the first overtone for the three CH bending modes are found to be very close to