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Catom_site_U_Fourier.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 Category ATOM_SITE_U_FOURIER Name: '_atom_site_U_Fourier_[]' Definition: Data items in the ATOM_SITE_U_FOURIER category record details about the Fourier components describing the modulation of the atomic thermal parameters in a modulated structure. Example: Example 1 - extracted ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Catom_site_U_Fourier.html

Iatom_site_rot_Fourier_param_sin.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_rot_Fourier_param_sin Name: '_atom_site_rot_Fourier_param_sin' Definition: The displacive distortion of a given rigid group is not completely described by _atom_site_displace_Fourier_. The rigid rotation of the group around a given axis ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_rot_Fourier_param_sin.html

Iatom_site_rot_Fourier_param_phase.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_rot_Fourier_param_phase Name: '_atom_site_rot_Fourier_param_phase' Definition: The displacive distortion of a given rigid group is not completely described by _atom_site_displace_Fourier_. The rigid rotation of the group around a given axis ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_rot_Fourier_param_phase.html

Iatom_site_rot_Fourier_param_modulus.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_rot_Fourier_param_modulus Name: '_atom_site_rot_Fourier_param_modulus' Definition: The displacive distortion of a given rigid group is not completely described by _atom_site_displace_Fourier_. The rigid rotation of the group around a given axis ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_rot_Fourier_param_modulus.html

Iatom_site_rot_Fourier_param_id.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_rot_Fourier_param_id Name: '_atom_site_rot_Fourier_param_id' Definition: A code identifying the (in general complex) coefficient of each term present in the Fourier series describing the rotational part of the displacive modulation of a given rigid ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_rot_Fourier_param_id.html

Iatom_site_rot_Fourier_param_cos.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_rot_Fourier_param_cos Name: '_atom_site_rot_Fourier_param_cos' Definition: The displacive distortion of a given rigid group is not completely described by _atom_site_displace_Fourier_. The rigid rotation of the group around a given axis ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_rot_Fourier_param_cos.html

Catom_site_rot_Fourier_param.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 Category ATOM_SITE_ROT_FOURIER_PARAM Name: '_atom_site_rot_Fourier_param_[]' Definition: Data items in the ATOM_SITE_ROT_FOURIER_PARAM category record details about the coefficients of the Fourier series used to describe the rotational component of the displacive modulation ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Catom_site_rot_Fourier_param.html

Iatom_site_rot_Fourier_wave_vector_seq_id.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_rot_Fourier_wave_vector_seq_id Name: '_atom_site_rot_Fourier_wave_vector_seq_id' Definition: A numeric code identifying the wave vectors of the Fourier terms used in the structural model to describe the modulation functions corresponding to the ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_rot_Fourier_wave_vector_seq_id.html

Iatom_site_rot_Fourier_id.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_rot_Fourier_id Name: '_atom_site_rot_Fourier_id' Definition: A code identifying each component of the rotational modulation of a given rigid group when the modulation is expressed in terms of Fourier series. Appears in list as essential element ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_rot_Fourier_id.html

Iatom_site_rot_Fourier_axis.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_rot_Fourier_axis Name: '_atom_site_rot_Fourier_axis' Definition: A label identifying the rotation component around a fixed point of a given rigid group whose modulation is being parameterized by Fourier series. a, b and c are the basic ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_rot_Fourier_axis.html

Iatom_site_rot_Fourier_atom_site_label.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_rot_Fourier_atom_site_label Name: '_atom_site_rot_Fourier_atom_site_label' Definition: Modulation parameters are usually looped in separate lists. Modulated parameters are the atom positions (displacive modulation), the atomic occupation (occupational modulation) and/or the atomic anisotropic ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_rot_Fourier_atom_site_label.html

Catom_site_rot_Fourier.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 Category ATOM_SITE_ROT_FOURIER Name: '_atom_site_rot_Fourier_[]' Definition: Data items in the ATOM_SITE_ROT_FOURIER category record details about the Fourier components present in the rotational part of the displacive modulation of a given rigid group. The translational ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Catom_site_rot_Fourier.html

Iatom_site_phason_formula.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_phason_formula Name: '_atom_site_phason_formula' Definition: The formula used for the phason correction. Although both kinds of corrections are intended to be overall, some refinement programs (for example, JANA2000) allow an independent phason correction for each atom or ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_phason_formula.html

Iatom_site_phason_coeff.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_phason_coeff Name: '_atom_site_phason_coeff' Definition: The phason coefficient used to calculate (with the appropriate expression given in _atom_site_phason_formula) the atomic phason correction. Although this kind of correction is intended to be overall, some refinement ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_phason_coeff.html

Iatom_site_phason_atom_site_label.html
Index Modulated and composite structures dictionary (msCIF) version 1.0.1 _atom_site_phason_atom_site_label Name: '_atom_site_phason_atom_site_label' Definition: The code that identifies an atom or rigid group in a loop in which the phason coefficients are listed. Although this kind of correction is intended to be ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Iatom_site_phason_atom_site_label.html


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