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PRLTAO 0031-9007 10.1103/PhysRevLett.58.1188
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B. K. Rao, P. Jena, M. Manninen, and R. M. Nieminen, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.58.1188 58, 1188 (1987).
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Rao, B.K.1
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Nieminen, R.M.4
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The total energy was obtained by relaxing the electrons. Atomic positions were kept fixed during the optimization.
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The total energy was obtained by relaxing the electrons. Atomic positions were kept fixed during the optimization.
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