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- W2000283118 abstract "The structural properties of the $mathrm{W}(001)p(1ifmmodetimeselsetexttimesfi{}1)ensuremath{-}2mathrm{H}$ system are predicted by use of all-electron total-energy calculations. Both the vibrational frequency (133 meV) and the work-function change (0.95 eV) are in excellent agreement with experiment at the calculated equilibrium H-W interlayer spacing of 1.12 AA{}. A proposed electronic driving mechanism, which includes local bonding effects and depends on the character of the ${overline{ensuremath{Sigma}}}_{2}$ surface-state wave functions, explains the various observed reconstructions of the clean-W(001) and H/W(001) systems, including symmetries and coverage dependence." @default.
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- W2000283118 date "1986-05-26" @default.
- W2000283118 modified "2023-09-23" @default.
- W2000283118 title "H and the W(001) Surface Reconstructions: Local Bonding to Surface States" @default.
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- W2000283118 doi "https://doi.org/10.1103/physrevlett.56.2295" @default.
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