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Density-functional calculations of defect formation energies using supercell methods: Defects in diamond Shim, J; Lee, Eok Kyun; Lee, YJ; Nieminen, RM, PHYSICAL REVIEW B, v.71, no.3, 2005-01 |
Density-functional calculations of defect formation energies using the supercell method: Brillouin-zone sampling Shim, J; Lee, Eok Kyun; Lee, YJ; Nieminen, RM, PHYSICAL REVIEW B, v.71, no.24, 2005-06 |
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