General Strategy for Direct Synthesis of L10Nanoparticle Alloys from Layered Precursor: The Case of FePt
Capobianchi, Aldo; Colapietro, Marcello; Fiorani, Dino; Foglia, Sabrina; Imperatori, Patrizia; Laureti, Sara; Palange, Elia; Chemistry of Materials 21 (2009) 2007–2009; doi:10.1021/cm9003992

data_4001020
_publ_section_title
;
 General Strategy for Direct Synthesis of L10Nanoparticle Alloys from
 Layered Precursor: The Case of FePt
;
_journal_coden_ASTM              CMATEX
_journal_issue                   10
_journal_name_full               'Chemistry of Materials'
_journal_page_first              2007
_journal_page_last               2009
_journal_paper_doi               10.1021/cm9003992
_journal_volume                  21
_journal_year                    2009
_chemical_formula_moiety         'Cl Pt, H2 Fe O'
_chemical_formula_sum            'Cl6 Fe H12 O6 Pt'
_chemical_formula_weight         571.74
_space_group_IT_number           148
_symmetry_cell_setting           trigonal
_symmetry_Int_Tables_number      148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   10.485
_cell_length_b                   10.485
_cell_length_c                   10.901
_cell_measurement_reflns_used    25
_cell_measurement_temperature    293
_cell_measurement_theta_max      30.00
_cell_measurement_theta_min      15.00
_cell_measurement_wavelength     0.71073
_cell_volume                     1037.848
_computing_molecular_graphics    ' SIR2004 (Burla et al., 2004)'
_computing_publication_material  ' SIR2004 (Burla et al., 2004)'
_computing_structure_refinement  ' SIR2004 (Burla et al., 2004)'
_computing_structure_solution    ' SIR2004 (Burla et al., 2004)'
_diffrn_ambient_temperature      293
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       0
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_theta_full        28.98
_diffrn_reflns_theta_max         28.98
_diffrn_reflns_theta_min         2.92
_exptl_absorpt_coefficient_mu    67.692
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.9800
_exptl_absorpt_correction_type   psi-scan
_exptl_crystal_density_diffrn    8.770
_exptl_crystal_F_000             2358
_refine_ls_abs_structure_details
;
;
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.164
_refine_ls_goodness_of_fit_gt    1.164
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     23
_refine_ls_number_reflns         555
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.026
_refine_ls_R_factor_gt           0.026
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     '     w=1/(829.4976+1.*F+0.0002*F^2^)'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         0.033
_refine_ls_wR_factor_gt          0.033
_reflns_d_resolution_high        0.734
_reflns_d_resolution_low         6.977
_reflns_limit_h_max              14
_reflns_limit_h_min              0
_reflns_limit_k_max              0
_reflns_limit_k_min              -11
_reflns_limit_l_max              14
_reflns_limit_l_min              -14
_reflns_number_gt                555
_reflns_number_total             555
_reflns_threshold_expression     ' F >3.0 \s(F) '
_cod_data_source_file            cm9003992_si_002.cif
_cod_data_source_block           global
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Trigonal' changed to 'trigonal'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from
2011-04-26.

'_refine_ls_matrix_type' value 'Full' changed to 'full'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from
2011-04-26.

'_atom_site_thermal_displace_type' value 'uani' changed
to 'Uani' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.2 from 2011-04-26 (4
times).

'_atom_site_thermal_displace_type' value 'uiso' changed to
'Uiso' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.2 from 2011-04-26 (2 times).

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 

 Updated bibliographic information.

 Antanas Vaitkus,
 2019-09-24

 Updated the values of the '_atom_site_type_symbol' and '_atom_type_symbol'
 data items in order to establish proper relationships between data loops.

 Antanas Vaitkus,
 2019-09-24
;
_cod_original_cell_volume        1037.85
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'H2 Cl Fe O Pt'
_cod_database_code               4001020