为了使默认值正确工作,标识操作应将_space_group_symop_id或_symmetry_equiv_pos_site_id设置为1,并将_space_group_symop_operation_xyz或_symmetry_equiv_pos_as_xyz设置为x, y, z;即标记为1的操作应该是本身操作。 May appear in list containing _space_group_symop_id. 可能出现在包含_space_group_...
Related item: _symmetry_space_group_name_H-M (alternate). 关联条目:_symmetry_space_group_name_H-M(备用)。 Example:; loopspace group idspace group name H-M alt1 ’C m c m’2 ’C 2/c 2/m 21/m’3 ’A m a m’; (three examples for space group No. 63) 示例:; loopspace gro...
Space group symmetry, spin-orbit coupling, and the low-energy effective Hamiltonian for iron-based superconductors. Phys. Rev. B, 88:134510, Oct 2013.V. Cvetkovic and O. Vafek, Space group symmetry, spin- orbit coupling, and the low-energy effective hamiltonian for iron-based superconductors,...
this structure; this must be corrected. (指的是Fddd空间群) 请问：space-group-imposed symmetry是...
Example:Pmna Group-Subgroup Relations Among the Crystal Classes The Equivalent Positions inI41/amd Group-Subgroup Relations Among Space Groups Some Subgroups ofI41/amd Superstructure Symmetry Operations in Subgroups The Subgroups ofP63/mmcin the Crystal ClassD2hArising from Doubling of a Bibliography ...
Thus far the treatment of symmetry has been restricted to the proper rotational and reflection symmetries of space lattices. The discussion of the symmetry of crystalline solids does not end with the presentation of the 14 Bravais lattice types because the symmetry of a solid is the symmetry of ...
The meaning of SPACE GROUP is a group or array of symmetry elements on the points of a space lattice.
symmetry_space_group_name_H-M数据怎么得到？
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Space group symmetry and Al- 0-P bond angles in A1P04-5 A. Rabdel Ruiz-Salvador,+ German Sastre, Dewi W. Lewis and C. Richard A. Catlow" Davy Faraday Laboratory, Royal Institution of Great Britain, 21 Albemarle St., London, UK W1X 4BS St... AR Ruiz-Salvador - 《Journal of Mate...