File name: Pandora127s1_Mainz-MPIC_20250805_L2Fit_ffuh5c5d20250721p1-8.txt
File generation date: 20250902T105918.5Z
Data description: Level 2 spectral fitting results file
Data file version: ffuh5c5p1-8
Local principal investigator: Thomas Wagner
Network principal investigator: Alexander Cede
Instrument type: Pandora
Instrument number: 127
Spectrometer number: 1
Processing software version used: BlickP v1.8.75
Instrument operation file used: Pandora127_OF_v4d20210611.txt
Instrument calibration file used: Pandora127s1_CF_v6d20250721.txt
Level 1 file used: Pandora127s1_Mainz-MPIC_20250805_L1_smca1c5d20250721p1-8.txt
Full location name: Max-Planck-Institute for Chemistry, Mainz
Short location name: Mainz-MPIC
Country of location: Germany
Location latitude [deg]: 49.9910
Location longitude [deg]: 8.2280
Location altitude [m]: 125
Local noon date: 20250805
Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method)
Data caveats: None
First and last pixel inside fitting window: 391 613
Nominal wavelengths inside fitting window [nm]: 328.5265 328.6651 328.8037 328.9423 329.0809 329.2194 329.3580 329.4965 329.6350 329.7735 329.9120 330.0505 330.1890 330.3274 330.4659 330.6043 330.7427 330.8811 331.0195 331.1579 331.2963 331.4346 331.5730 331.7113 331.8497 331.9880 332.1263 332.2646 332.4028 332.5411 332.6793 332.8176 332.9558 333.0940 333.2322 333.3704 333.5086 333.6468 333.7849 333.9231 334.0612 334.1993 334.3374 334.4755 334.6136 334.7517 334.8897 335.0278 335.1658 335.3038 335.4418 335.5798 335.7178 335.8558 335.9938 336.1317 336.2696 336.4076 336.5455 336.6834 336.8213 336.9592 337.0970 337.2349 337.3727 337.5105 337.6483 337.7862 337.9239 338.0617 338.1995 338.3372 338.4750 338.6127 338.7504 338.8881 339.0258 339.1635 339.3012 339.4388 339.5765 339.7141 339.8517 339.9894 340.1270 340.2645 340.4021 340.5397 340.6772 340.8148 340.9523 341.0898 341.2273 341.3648 341.5023 341.6397 341.7772 341.9146 342.0520 342.1894 342.3268 342.4642 342.6016 342.7390 342.8763 343.0137 343.1510 343.2883 343.4256 343.5629 343.7002 343.8375 343.9747 344.1120 344.2492 344.3864 344.5236 344.6608 344.7980 344.9352 345.0723 345.2095 345.3466 345.4837 345.6208 345.7579 345.8950 346.0321 346.1691 346.3062 346.4432 346.5802 346.7173 346.8543 346.9912 347.1282 347.2652 347.4021 347.5391 347.6760 347.8129 347.9498 348.0867 348.2236 348.3604 348.4973 348.6341 348.7709 348.9077 349.0445 349.1813 349.3181 349.4549 349.5916 349.7284 349.8651 350.0018 350.1385 350.2752 350.4119 350.5485 350.6852 350.8218 350.9585 351.0951 351.2317 351.3683 351.5048 351.6414 351.7780 351.9145 352.0510 352.1876 352.3241 352.4605 352.5970 352.7335 352.8699 353.0064 353.1428 353.2792 353.4156 353.5520 353.6884 353.8248 353.9611 354.0975 354.2338 354.3701 354.5064 354.6427 354.7790 354.9152 355.0515 355.1877 355.3240 355.4602 355.5964 355.7326 355.8688 356.0049 356.1411 356.2772 356.4133 356.5495 356.6856 356.8216 356.9577 357.0938 357.2298 357.3659 357.5019 357.6379 357.7739 357.9099 358.0459 358.1818 358.3178 358.4537 358.5897 358.7256 358.8615 358.9974
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Column 1: Two letter code of measurement routine
Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601)
Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement
Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.)
Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.)
Column 6: Total duration of measurement set in seconds
Column 7: Data processing type index
Column 8: Solar zenith angle for center-time of measurement in degree
Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise
Column 10: Lunar zenith angle for center-time of measurement in degree
Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise
Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used
Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon
Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used
Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4)
Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error
Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done
Column 18: rms of unweighted fitting residuals, -9=fitting not successful
Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used
Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given
Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given
Column 22: Formaldehyde slant column amount [moles per square meter], -9e99=fitting not successful
Column 23: Independent uncertainty of formaldehyde slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful
Column 24: Structured uncertainty of formaldehyde slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful
Column 25: Common uncertainty of formaldehyde slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful
Column 26: rms-based uncertainty of formaldehyde slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful
Column 27: Formaldehyde effective temperature [K]
Column 28: Independent uncertainty of formaldehyde effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful
Column 29: Structured uncertainty of formaldehyde effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful
Column 30: Common uncertainty of formaldehyde effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful
Column 31: Effective formaldehyde fitting wavelength [nm], -9=fitting not successful
Column 32: Diffuse correction applied before fitting at effective fitting wavelength for formaldehyde [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction
Column 33: Nitrogen dioxide slant column amount [moles per square meter], -9e99=fitting not successful
Column 34: Independent uncertainty of nitrogen dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful
Column 35: Structured uncertainty of nitrogen dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful
Column 36: Common uncertainty of nitrogen dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful
Column 37: rms-based uncertainty of nitrogen dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful
Column 38: Nitrogen dioxide effective temperature [K]
Column 39: Independent uncertainty of nitrogen dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful
Column 40: Structured uncertainty of nitrogen dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful
Column 41: Common uncertainty of nitrogen dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful
Column 42: Effective nitrogen dioxide fitting wavelength [nm], -9=fitting not successful
Column 43: Diffuse correction applied before fitting at effective fitting wavelength for nitrogen dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction
Column 44: Oxygen dimer slant column amount [moles squared per meter to the 5th], -9e99=fitting not successful
Column 45: Independent uncertainty of oxygen dimer slant column amount [moles squared per meter to the 5th], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful
Column 46: Structured uncertainty of oxygen dimer slant column amount [moles squared per meter to the 5th], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful
Column 47: Common uncertainty of oxygen dimer slant column amount [moles squared per meter to the 5th], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful
Column 48: rms-based uncertainty of oxygen dimer slant column amount [moles squared per meter to the 5th], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful
Column 49: Oxygen dimer effective temperature [K]
Column 50: Independent uncertainty of oxygen dimer effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful
Column 51: Structured uncertainty of oxygen dimer effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful
Column 52: Common uncertainty of oxygen dimer effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful
Column 53: Effective oxygen dimer fitting wavelength [nm], -9=fitting not successful
Column 54: Diffuse correction applied before fitting at effective fitting wavelength for oxygen dimer [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction
Column 55: Ozone slant column amount [moles per square meter], -9e99=fitting not successful
Column 56: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful
Column 57: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful
Column 58: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful
Column 59: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful
Column 60: Ozone effective temperature [K]
Column 61: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful
Column 62: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful
Column 63: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful
Column 64: Effective ozone fitting wavelength [nm], -9=fitting not successful
Column 65: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction
Column 66: Fitted Ring spectrum, -9e99=no fitting done or fitting not successful
Column 67: Independent uncertainty of fitted Ring spectrum, -9=fitting not successful
Column 68: Structured uncertainty of fitted Ring spectrum, -9=fitting not successful
Column 69: Common uncertainty of fitted Ring spectrum, -9=fitting not successful
Column 70: rms-based uncertainty of fitted Ring spectrum, -9=fitting not successful
Column 71: Effective Ring fitting wavelength [nm], -9=fitting not done or not successful
Column 72: Diffuse correction applied before fitting at effective Ring fitting wavelength [%], 0=no diffuse correction applied, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction
Column 73: Lower limit used for wavelength scaling [nm]
Column 74: Upper limit used for wavelength scaling [nm]
Column 75: Order of smoothing polynomial
Column 76: Smoothing polynomial coefficient, order 0
Column 77: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful
Column 78: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful
Column 79: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful
Column 80: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful
Column 81: Smoothing polynomial coefficient, order 1
Column 82: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful
Column 83: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful
Column 84: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful
Column 85: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful
Column 86: Smoothing polynomial coefficient, order 2
Column 87: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful
Column 88: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful
Column 89: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful
Column 90: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful
Column 91: Smoothing polynomial coefficient, order 3
Column 92: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful
Column 93: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful
Column 94: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful
Column 95: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful
Column 96: Smoothing polynomial coefficient, order 4
Column 97: Independent uncertainty of smoothing polynomial coefficient, order 4, -9=fitting not successful
Column 98: Structured uncertainty of smoothing polynomial coefficient, order 4, -9=fitting not successful
Column 99: Common uncertainty of smoothing polynomial coefficient, order 4, -9=fitting not successful
Column 100: rms-based uncertainty of smoothing polynomial coefficient, order 4, -9=fitting not successful
Column 101: Mean value of measured data inside fitting window [same units as measurements]
Column 102: Offset polynomial coefficient, order 0
Column 103: Independent uncertainty of offset polynomial coefficient, order 0, -9=fitting not successful
Column 104: Structured uncertainty of offset polynomial coefficient, order 0, -9=fitting not successful
Column 105: Common uncertainty of offset polynomial coefficient, order 0, -9=fitting not successful
Column 106: rms-based uncertainty of offset polynomial coefficient, order 0, -9=fitting not successful
Column 107: Offset polynomial coefficient, order 1
Column 108: Independent uncertainty of offset polynomial coefficient, order 1, -9=fitting not successful
Column 109: Structured uncertainty of offset polynomial coefficient, order 1, -9=fitting not successful
Column 110: Common uncertainty of offset polynomial coefficient, order 1, -9=fitting not successful
Column 111: rms-based uncertainty of offset polynomial coefficient, order 1, -9=fitting not successful
Column 112: Wavelength change polynomial coefficient, order 0
Column 113: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful
Column 114: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful
Column 115: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful
Column 116: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful
Column 117: Wavelength change polynomial coefficient, order 1
Column 118: Independent uncertainty of wavelength change polynomial coefficient, order 1, -9=fitting not successful
Column 119: Structured uncertainty of wavelength change polynomial coefficient, order 1, -9=fitting not successful
Column 120: Common uncertainty of wavelength change polynomial coefficient, order 1, -9=fitting not successful
Column 121: rms-based uncertainty of wavelength change polynomial coefficient, order 1, -9=fitting not successful
Column 122: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination
Column 123: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination
Column 124: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality
Column 125: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large
Column 126: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1)
Column 127: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality
Column 128: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature
Column 129: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1)
Column 130: Atmospheric variability [%], 999=no atmospheric variability was determined
Column 131: Wavelength effective temperature [°C], 999=no effective temperature given
Column 132: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher)
Column 133: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination
Column 134: Retrieved total wavelength shift [nm], -9=no wavelength change fitting
Column 135: Number of bright count cycles
Column 136: Number of dark count cycles
Column 137: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions
Column 138: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions
Column 139: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal
Column 140: Integration time [ms]
Column 141: Spectrometer control temperature [°C], 999=no temperature signal
Column 142: Auxiliary spectrometer temperature [°C], 999=no temperature signal
Column 143: Temperature in head sensor [°C], 999=no temperature signal
Column 144: Temperature at electronics board 1 [°C], 999=no temperature signal
Column 145: Temperature at electronics board 2 [°C], 999=no temperature signal
Column 146: Humidity in head sensor [%], -9=no humidity signal
Column 147: Pressure in head sensor [hPa], -9=no pressure signal
Columns 148-370: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting
Columns 371-593: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given
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