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herouying捐助貴賓 (初入文壇)
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[求助]
求助KC8的cif 石墨與金屬鉀反應(yīng)生成的鉀的石墨插層化合物KC8的晶體cif 已有1人參與
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| 求助KC8的cif 石墨與金屬鉀反應(yīng)生成的鉀的石墨插層化合物KC8的晶體cif |
捐助貴賓 (初入文壇)
木蟲 (正式寫手)
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# generated using pymatgen data_KC8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.97615600 _cell_length_b 8.63161000 _cell_length_c 21.44108000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural KC8 _chemical_formula_sum 'K8 C64' _cell_volume 920.94236880 _cell_formula_units_Z 8 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy K K0 1 0.00000000 0.00000000 0.00000000 1 K K1 1 0.25000000 0.75000000 0.75000000 1 K K2 1 0.00000000 0.50000000 0.50000000 1 K K3 1 0.25000000 0.25000000 0.25000000 1 K K4 1 0.50000000 0.00000000 0.50000000 1 K K5 1 0.75000000 0.75000000 0.25000000 1 K K6 1 0.50000000 0.50000000 0.00000000 1 K K7 1 0.75000000 0.25000000 0.75000000 1 C C8 1 0.25010150 0.91631600 0.87505050 1 C C9 1 0.25010150 0.58368400 0.62494950 1 C C10 1 0.24989850 0.91631600 0.62494950 1 C C11 1 0.24989850 0.58368400 0.87505050 1 C C12 1 0.99989850 0.83368400 0.87494950 1 C C13 1 0.99989850 0.66631600 0.62505050 1 C C14 1 0.50010150 0.83368400 0.62505050 1 C C15 1 0.50010150 0.66631600 0.87494950 1 C C16 1 0.74993400 0.91629900 0.87413000 1 C C17 1 0.74993400 0.58370100 0.62587000 1 C C18 1 0.75006600 0.91629900 0.62587000 1 C C19 1 0.75006600 0.58370100 0.87413000 1 C C20 1 0.50006600 0.83370100 0.87587000 1 C C21 1 0.50006600 0.66629900 0.62413000 1 C C22 1 0.99993400 0.83370100 0.62413000 1 C C23 1 0.99993400 0.66629900 0.87587000 1 C C24 1 0.25010150 0.41631600 0.37505050 1 C C25 1 0.25010150 0.08368400 0.12494950 1 C C26 1 0.24989850 0.41631600 0.12494950 1 C C27 1 0.24989850 0.08368400 0.37505050 1 C C28 1 0.99989850 0.33368400 0.37494950 1 C C29 1 0.99989850 0.16631600 0.12505050 1 C C30 1 0.50010150 0.33368400 0.12505050 1 C C31 1 0.50010150 0.16631600 0.37494950 1 C C32 1 0.74993400 0.41629900 0.37413000 1 C C33 1 0.74993400 0.08370100 0.12587000 1 C C34 1 0.75006600 0.41629900 0.12587000 1 C C35 1 0.75006600 0.08370100 0.37413000 1 C C36 1 0.50006600 0.33370100 0.37587000 1 C C37 1 0.50006600 0.16629900 0.12413000 1 C C38 1 0.99993400 0.33370100 0.12413000 1 C C39 1 0.99993400 0.16629900 0.37587000 1 C C40 1 0.75010150 0.91631600 0.37505050 1 C C41 1 0.75010150 0.58368400 0.12494950 1 C C42 1 0.74989850 0.91631600 0.12494950 1 C C43 1 0.74989850 0.58368400 0.37505050 1 C C44 1 0.49989850 0.83368400 0.37494950 1 C C45 1 0.49989850 0.66631600 0.12505050 1 C C46 1 0.00010150 0.83368400 0.12505050 1 C C47 1 0.00010150 0.66631600 0.37494950 1 C C48 1 0.24993400 0.91629900 0.37413000 1 C C49 1 0.24993400 0.58370100 0.12587000 1 C C50 1 0.25006600 0.91629900 0.12587000 1 C C51 1 0.25006600 0.58370100 0.37413000 1 C C52 1 0.00006600 0.83370100 0.37587000 1 C C53 1 0.00006600 0.66629900 0.12413000 1 C C54 1 0.49993400 0.83370100 0.12413000 1 C C55 1 0.49993400 0.66629900 0.37587000 1 C C56 1 0.75010150 0.41631600 0.87505050 1 C C57 1 0.75010150 0.08368400 0.62494950 1 C C58 1 0.74989850 0.41631600 0.62494950 1 C C59 1 0.74989850 0.08368400 0.87505050 1 C C60 1 0.49989850 0.33368400 0.87494950 1 C C61 1 0.49989850 0.16631600 0.62505050 1 C C62 1 0.00010150 0.33368400 0.62505050 1 C C63 1 0.00010150 0.16631600 0.87494950 1 C C64 1 0.24993400 0.41629900 0.87413000 1 C C65 1 0.24993400 0.08370100 0.62587000 1 C C66 1 0.25006600 0.41629900 0.62587000 1 C C67 1 0.25006600 0.08370100 0.87413000 1 C C68 1 0.00006600 0.33370100 0.87587000 1 C C69 1 0.00006600 0.16629900 0.62413000 1 C C70 1 0.49993400 0.33370100 0.62413000 1 C C71 1 0.49993400 0.16629900 0.87587000 1 |
木蟲 (正式寫手)
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