Na<sub>2</sub>VO(HPO<sub>4</sub>)<sub>2</sub>: an original phase solved by continuous 3D electron diffraction and powder X-ray diffraction.
Lepoittevin, C.; Leynaud, O.; Neveu, A.; Barbier, T.; Gnanavel, M.; Gopal, V.; Pralong, V.; Dalton transactions (Cambridge, England : 2003) 50 (2021) 9725–9734; doi:10.1039/d1dt01548f

data_7707707
_publ_section_title
;
 Na<sub>2</sub>VO(HPO<sub>4</sub>)<sub>2</sub>: an original phase solved
 by continuous 3D electron diffraction and powder X-ray diffraction.
;
_journal_issue                   28
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              9725
_journal_page_last               9734
_journal_paper_doi               10.1039/d1dt01548f
_journal_volume                  50
_journal_year                    2021
_chemical_formula_sum            'H8 Na8 O36 P8 V4'
_chemical_formula_weight         1219.50
_space_group_IT_number           45
_space_group_name_Hall           'I 2 -2c'
_space_group_name_H-M_alt        'I b a 2'
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'I 2 -2c'
_symmetry_space_group_name_H-M   'I b a 2'
_cell_angle_alpha                90.0000
_cell_angle_beta                 90.0000
_cell_angle_gamma                90.0000
_cell_formula_units_Z            2
_cell_length_a                   13.86852(19)
_cell_length_b                   13.7985(2)
_cell_length_c                   7.47677(9)
_cell_measurement_temperature    295
_cell_volume                     1430.79(3)
_computing_structure_refinement  FULLPROF
_diffrn_ambient_temperature      295
_diffrn_measurement_device_type  'Bruker D8Advance'
_diffrn_radiation_type           'Cu K\a'
_diffrn_source                   'sealed X-ray tube'
_diffrn_source_target            Cu
_pd_char_colour                  light_blue
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.010488
_pd_meas_2theta_range_max        100.00200
_pd_meas_2theta_range_min        10.06290
_pd_meas_number_of_points        8577
_pd_proc_2theta_range_inc        0.010488
_pd_proc_2theta_range_max        100.0020
_pd_proc_2theta_range_min        10.0629
_pd_proc_ls_pref_orient_corr     ' ?'
_pd_proc_ls_prof_R_factor        9.9445
_pd_proc_ls_prof_wR_expected     3.2264
_pd_proc_ls_prof_wR_factor       14.3864
_pd_proc_wavelength              1.540560
_pd_spec_mounting                ' ?'
_refine_ls_goodness_of_fit_all   4.46
_refine_ls_number_parameters     49
_refine_ls_number_reflns         437
_refine_ls_number_restraints     0
_refine_ls_R_I_factor            28.7738
_cod_data_source_file            d1dt01548f1.cif
_cod_data_source_block           NaVPOH
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Orthorhombic' was changed
to 'orthorhombic' in accordance with the
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas 

 Adding full bibliography for 7707707.cif.
;
_cod_database_code               7707707
_pd_proc_ls_prof_cr_factor       30.6852
_pd_proc_ls_prof_cwr_factor      31.1931
_pd_proc_ls_prof_cwr_expected    6.9956
_pd_proc_ls_prof_chi2            19.8824
_pd_proc_ls_prof_echi2           21.1948