| 1 | # GSAS-II powder instrument template file |
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| 2 | |
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| 3 | data_Instrument_Template |
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| 4 | #============================================================================== |
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| 5 | # 9. INSTRUMENT CHARACTERIZATION |
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| 6 | |
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| 7 | _exptl_special_details |
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| 8 | ; ? |
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| 9 | ; |
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| 10 | |
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| 11 | # if regions of the data are excluded, the reason(s) are supplied here: |
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| 12 | _pd_proc_info_excluded_regions |
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| 13 | ; ? |
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| 14 | ; |
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| 15 | |
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| 16 | # The following item is used to identify the equipment used to record |
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| 17 | # the powder pattern when the diffractogram was measured at a laboratory |
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| 18 | # other than the authors' home institution, e.g. when neutron or synchrotron |
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| 19 | # radiation is used. |
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| 20 | |
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| 21 | _pd_instr_location |
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| 22 | ; ? |
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| 23 | ; |
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| 24 | _pd_calibration_special_details # description of the method used |
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| 25 | # to calibrate the instrument |
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| 26 | ; ? |
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| 27 | ; |
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| 28 | |
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| 29 | _diffrn_source ? |
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| 30 | _diffrn_source_target ? |
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| 31 | _diffrn_source_type ? |
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| 32 | _diffrn_measurement_device_type ? |
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| 33 | _diffrn_detector ? |
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| 34 | _diffrn_detector_type ? # make or model of detector |
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| 35 | |
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| 36 | _pd_meas_scan_method ? # options are 'step', 'cont', |
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| 37 | # 'tof', 'fixed' or |
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| 38 | # 'disp' (= dispersive) |
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| 39 | _pd_meas_special_details |
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| 40 | ; ? |
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| 41 | ; |
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| 42 | |
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| 43 | # The following two items identify the program(s) used (if appropriate). |
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| 44 | _computing_data_collection ? |
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| 45 | _computing_data_reduction ? |
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| 46 | |
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| 47 | # Describe any processing performed on the data, prior to refinement. |
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| 48 | # For example: a manual Lp correction or a precomputed absorption correction |
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| 49 | _pd_proc_info_data_reduction ? |
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| 50 | |
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| 51 | # The following item is used for angular dispersive measurements only. |
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| 52 | |
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| 53 | _diffrn_radiation_monochromator ? |
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| 54 | |
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| 55 | # The following items are used to define the size of the instrument. |
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| 56 | # Not all distances are appropriate for all instrument types. |
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| 57 | |
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| 58 | _pd_instr_dist_src/mono ? |
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| 59 | _pd_instr_dist_mono/spec ? |
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| 60 | _pd_instr_dist_src/spec ? |
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| 61 | _pd_instr_dist_spec/anal ? |
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| 62 | _pd_instr_dist_anal/detc ? |
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| 63 | _pd_instr_dist_spec/detc ? |
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| 64 | |
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| 65 | # 10. Specimen size and mounting information |
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| 66 | |
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| 67 | # The next three fields give the specimen dimensions in mm. The equatorial |
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| 68 | # plane contains the incident and diffracted beam. |
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| 69 | |
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| 70 | _pd_spec_size_axial ? # perpendicular to |
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| 71 | # equatorial plane |
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| 72 | |
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| 73 | _pd_spec_size_equat ? # parallel to |
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| 74 | # scattering vector |
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| 75 | # in transmission |
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| 76 | |
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| 77 | _pd_spec_size_thick ? # parallel to |
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| 78 | # scattering vector |
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| 79 | # in reflection |
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| 80 | |
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| 81 | _pd_spec_mounting # This field should be |
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| 82 | # used to give details of the |
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| 83 | # container. |
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| 84 | ; ? |
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| 85 | ; |
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| 86 | |
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| 87 | _pd_spec_mount_mode ? # options are 'reflection' |
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| 88 | # or 'transmission' |
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| 89 | |
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| 90 | _pd_spec_shape ? # options are 'cylinder' |
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| 91 | # 'flat_sheet' or 'irregular' |
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| 92 | |
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