μCHILL: a lightweight, modular system for handling crystalline samples at low temperatures under inert conditions
Solar, Michael; Trapp, Nils; Journal of Applied Crystallography 51 (2018) –; doi:10.1107/S1600576718003291

data_2300631
_publ_section_title
;
 \mCHILL: a lightweight, modular system for handling crystalline samples
 at low temperatures under inert conditions
;
_journal_coeditor_code           GJ5200
_journal_issue                   2
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first
;
;
_journal_paper_doi               10.1107/S1600576718003291
_journal_volume                  51
_journal_year                    2018
_chemical_formula_moiety         '0.25(B4 H16 Li4)'
_chemical_formula_sum            'B H4 Li'
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_chemical_name_systematic        'Lithium borohydride'
_space_group_crystal_system      orthorhombic
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_space_group_name_Hall           '-P 2ac 2n'
_space_group_name_H-M_alt        'P n m a'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
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Olex2 1.2
(compiled 2017.08.10 svn.r3458 for OlexSys, GUI svn.r5381)
;
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;
Superflip (Palatinus & Chapuis, 2007;Palatinus & van der Lee, 2008;
Palatinus et al., 2012)
;
_diffrn_ambient_temperature      100.00(10)
_diffrn_measured_fraction_theta_full 0.986
_diffrn_measured_fraction_theta_max 0.986
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Synergy, Dualflex, Pilatus 300K'
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_diffrn_radiation_monochromator  mirror
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
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_diffrn_reflns_theta_full        66.020
_diffrn_reflns_theta_max         66.020
_diffrn_reflns_theta_min         9.078
_exptl_absorpt_coefficient_mu    0.094
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.55327
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_exptl_absorpt_process_details
;
CrysAlisPro 1.171.39.31d (Rigaku Oxford Diffraction, 2017)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            'clear colourless'
_exptl_crystal_density_diffrn    0.685
_exptl_crystal_description       plank
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_exptl_crystal_size_max          0.125
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_exptl_crystal_size_min          0.064
_refine_diff_density_max         0.156
_refine_diff_density_min         -0.102
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_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.1068P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_refine_ls_wR_factor_ref         0.1381
_reflns_number_gt                195
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_database_code               2300631
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