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Using the one atom theory, the electronic structures of pure Cr, Mo and W with bcc structure were determined respectively as: [Ar](3dc)3.32(3dn)2.26(4sc)0.25(4sf)0.17, [Kr](4dc)4.23(4dn)1.48(5sc)0.02(5sf)0.27 and [Xe](5dc)5.16(6sc)0.25(6sf)0.59.The electr