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CO puzzle FCC overbind

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PBE overbinding energy compared to vdW-DF calculation for a CO molecule on Pt(111) surface at 1/12 coverage.

Category: Tech
Uploaded: October 7th, 2008 @ 12:36 pm
Author: plazicx

Length: 00:28
Rating:
Views: 110

Tags: co density functional nonlocal pt(111) puzzle

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