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- W2019432245 abstract "Charge overlap and molecular orbital energies for the -(M2)- linear chain unit are computed for selected transition metals. For valid comparison, uniform parameters are used starting with the type of dnsp excited configuration of the atoms that is favorable to linear digonal hybrid bonding. Stabilities of the chains are then compared. Bond order and bond energies of σ, π, and δ bonds for the d molecular orbitals are deduced. Results support the existence of linear chains of group V or group VI atoms as the A atoms in superconducting A3B alloys. Conjugated resonance structures are drawn for all multiple bonds in the chains. A possible relationship between chain integrity (and conjugation) and conductivity in such alloys is suggested." @default.
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- W2019432245 date "1982-12-01" @default.
- W2019432245 modified "2023-10-17" @default.
- W2019432245 title "Multiple metal-metal bonding and A-chain integrity in superconducting A3B (β-tungsten) alloy" @default.
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- W2019432245 doi "https://doi.org/10.1016/0022-4596(82)90181-5" @default.
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