File name: Pandora120s1_Davos_20241014_L2Fit_fout2c5d20240814p1-8.txt File generation date: 20241127T224745.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Julian Groebner Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 120 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora120_OF_v5d20190819.txt Instrument calibration file used: Pandora120s1_CF_v5d20240814.txt Level 1 file used: Pandora120s1_Davos_20241014_L1_smca1c5d20240814p1-8.txt Full location name: PMOD/WRC-Davos Short location name: Davos Country of location: Switzerland Location latitude [deg]: 46.8129 Location longitude [deg]: 9.8437 Location altitude [m]: 1590 Local noon date: 20241014 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: 227 368 Nominal wavelengths inside fitting window [nm]: 305.1159 305.2573 305.3987 305.5401 305.6814 305.8228 305.9641 306.1054 306.2467 306.3880 306.5293 306.6706 306.8118 306.9531 307.0943 307.2356 307.3768 307.5180 307.6592 307.8004 307.9415 308.0827 308.2239 308.3650 308.5061 308.6473 308.7884 308.9295 309.0706 309.2116 309.3527 309.4938 309.6348 309.7758 309.9169 310.0579 310.1989 310.3399 310.4808 310.6218 310.7627 310.9037 311.0446 311.1855 311.3265 311.4674 311.6082 311.7491 311.8900 312.0308 312.1717 312.3125 312.4533 312.5941 312.7349 312.8757 313.0165 313.1573 313.2980 313.4388 313.5795 313.7202 313.8609 314.0016 314.1423 314.2830 314.4237 314.5643 314.7050 314.8456 314.9862 315.1268 315.2674 315.4080 315.5486 315.6891 315.8297 315.9702 316.1108 316.2513 316.3918 316.5323 316.6728 316.8133 316.9537 317.0942 317.2346 317.3750 317.5155 317.6559 317.7963 317.9366 318.0770 318.2174 318.3577 318.4981 318.6384 318.7787 318.9190 319.0593 319.1996 319.3399 319.4801 319.6204 319.7606 319.9008 320.0410 320.1813 320.3214 320.4616 320.6018 320.7420 320.8821 321.0222 321.1624 321.3025 321.4426 321.5827 321.7227 321.8628 322.0029 322.1429 322.2829 322.4230 322.5630 322.7030 322.8430 322.9829 323.1229 323.2629 323.4028 323.5427 323.6827 323.8226 323.9625 324.1023 324.2422 324.3821 324.5219 324.6618 324.8016 324.9414 --------------------------------------------------------------------------------------- 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: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: 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 24: 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 25: 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 26: 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 27: Ozone effective temperature [K] Column 28: 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 29: 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 30: 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 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: 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 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur 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 sulfur 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 sulfur 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 sulfur 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: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur 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 sulfur 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 sulfur 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 sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: 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 78: 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 79: 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 80: 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 81: 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 82: 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 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-384: 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 --------------------------------------------------------------------------------------- SU 20241014T064046.8Z 9053.278320 132 1 42.50 2 80.53 113.14 139.17 319.72 0.00 1 0.00 1 0 25 3.020e-01 5.888e-03 3.204e-01 6.008e-03 6.930990e-01 3.233301e-03 7.816521e-03 -6.000000e+00 1.682816e-01 224.37 -2.00 3.62 -2.00 321.29 0.00e+00 2.240681e-03 1.276663e-03 7.295216e-04 -6.000000e+00 8.019826e-03 271.10 -2.00 20.00 -2.00 320.96 0.00e+00 5.799 0.004 302.00 328.00 3 3.1532e+00 9.7306e-03 6.0456e-02 -6.0000e+00 4.1720e-01 6.3134e-02 1.4608e-02 3.8059e-02 -6.0000e+00 4.5797e-01 -1.2362e-02 1.8382e-02 2.1793e-02 -6.0000e+00 2.6772e-01 -9.2881e-03 9.0361e-03 7.4319e-03 -6.0000e+00 1.1676e-01 9.0414e-05 -6.6513e-05 1.6699e-04 7.9912e-05 -6.0000e+00 7.9692e-03 1.4179e-02 0.0000e+00 12 1 1 12 1 1 99.80 14.22 0.20 0.01418 0.01368 28 7 2 8 0 1465.240 15.00 14.22 9.13 19.96 20.14 28.6 791.68 900000 -56553 900000 900000 900000 900000 -183890 -120768 -16765 -70634 900000 900000 -34756 900000 -49298 89021 -37296 31359 2155 172559 45190 -9970 -107 -31609 -34872 41009 70165 17575 21799 29995 9667 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-618 -1549 -1600 -518 -7 -218 823 -58 333 1450 -456 844 647 455 -220 -1215 -817 -401 849 -460 490 -35 106 1468 80 -4 1032 -872 -125 -430 -228 -405 -454 633 -492 -718 360 271 794 SU 20241014T065045.7Z 9053.285251 137 1 50.01 2 78.97 115.09 140.15 322.99 0.00 1 0.00 1 0 25 1.599e-01 4.808e-03 1.435e-01 1.632e-03 6.149633e-01 8.281573e-04 7.033619e-03 -6.000000e+00 8.783529e-02 224.36 -2.00 3.62 -2.00 320.91 0.00e+00 1.374062e-03 2.988431e-04 5.193245e-04 -6.000000e+00 3.587022e-03 271.10 -2.00 20.00 -2.00 320.59 0.00e+00 5.049 0.002 302.00 328.00 3 1.6017e+00 2.4059e-03 5.2704e-02 -6.0000e+00 2.1833e-01 3.7667e-02 3.2515e-03 3.2874e-02 -6.0000e+00 2.3903e-01 -1.5799e-02 3.8354e-03 1.8091e-02 -6.0000e+00 1.4080e-01 -4.9674e-03 1.9629e-03 5.9479e-03 -6.0000e+00 5.9598e-02 8.4385e-04 -2.7172e-04 4.4391e-05 6.0304e-05 -6.0000e+00 4.0396e-03 1.4542e-02 0.0000e+00 10 0 0 10 0 0 99.88 14.22 0.18 0.01454 0.01250 241 49 2 8 0 206.640 14.99 14.22 9.67 19.96 20.14 29.0 794.99 14792 -31020 -27472 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276 -263 339 31 -36 -45 -314 122 -200 -273 -662 -1095 -1204 -699 -766 -158 -383 435 361 740 581 605 733 590 178 354 925 144 0 -287 -69 -105 241 -1328 -1188 -1082 -757 -189 75 -82 -168 539 199 500 752 1001 200 -14 -1142 -867 -396 320 -584 717 157 972 1586 311 350 280 -83 -202 128 -560 -466 -136 153 -317 -658 250 -176 684 SU 20241014T070120.0Z 9053.292592 142 1 36.92 2 77.35 117.19 141.10 326.58 0.00 1 0.00 1 0 25 2.642e-01 5.372e-03 1.930e-01 4.431e-03 5.442511e-01 2.231163e-03 6.367519e-03 -6.000000e+00 1.451892e-01 224.36 -2.00 3.62 -2.00 320.37 0.00e+00 6.352827e-04 7.063713e-04 3.696010e-04 -6.000000e+00 6.015898e-03 271.10 -2.00 20.00 -2.00 320.05 0.00e+00 4.447 0.002 302.00 328.00 3 3.9489e+00 6.2998e-03 4.6431e-02 -6.0000e+00 3.6091e-01 4.5127e-02 7.9157e-03 2.8788e-02 -6.0000e+00 3.9510e-01 -2.1988e-03 8.5104e-03 1.5465e-02 -6.0000e+00 2.3293e-01 -1.1613e-02 4.4836e-03 4.9505e-03 -6.0000e+00 9.9107e-02 1.3809e-04 -6.4798e-05 1.2115e-04 4.9231e-05 -6.0000e+00 6.7162e-03 1.3589e-02 0.0000e+00 12 1 1 12 9 1 99.65 14.23 0.10 0.01359 0.01310 18 5 1 8 0 1942.510 15.01 14.23 10.15 19.96 20.14 28.7 796.03 -53229 -648 900000 -64207 -21345 25046 -3686 -14951 140597 -65247 -37858 -20888 2441 2344 -18710 29540 -17759 6760 -3558 10428 -21476 -1044 4052 -10672 -10656 -3844 -447 3524 -3793 -899 5185 1653 237778 -2708 -7489 -9854 6485 309 2653 -4223 -772 -3451 2618 -3390 875 1476 -900 -1049 -2126 -2187 102 935 -978 817 -1188 377 334 721 1197 3653 3382 2572 2237 680 1120 125 -746 1426 274 163 602 -749 1467 412 -743 -733 186 795 -630 -1253 -31 -2141 -831 -1297 -733 -494 904 -315 626 787 546 207 577 617 649 234 -106 387 128 249 -851 485 -563 -1288 -912 -743 -536 124 -166 128 -8 187 182 17 270 339 -17 -45 -60 -589 -27 334 120 354 -95 334 757 395 137 231 -112 29 22 115 -434 172 53 -96 -263 -165 71 65 -496 -4 900000 -701 -141 114 -24 -129 607 -1098 -508 -280 33 39 -472 524 -553 180 -112 299 -850 -34 137 -463 -499 -175 -19 139 -161 -42 269 103 1752 -194 -531 -757 495 31 319 -627 -120 -581 428 -592 149 253 -160 -192 -410 -459 23 234 -271 237 -366 119 106 222 357 1073 1076 931 915 302 480 52 -310 622 133 89 346 -437 799 220 -359 -321 79 360 -341 -756 -21 -1635 -660 -1102 -664 -472 881 -311 592 692 444 158 438 513 619 244 -127 504 168 305 -945 506 -598 -1428 -1067 -908 -693 172 -245 207 -13 315 292 25 398 498 -26 -71 -100 -978 -43 511 178 524 -135 450 1044 614 228 416 -213 54 44 245 -976 376 119 -213 -587 -347 140 124 SU 20241014T070651.3Z 9053.296427 145 1 50.01 2 76.51 118.29 141.56 328.51 0.00 1 0.00 1 0 17 8.130e-02 4.991e-03 4.649e-02 1.605e-03 5.176248e-01 7.971814e-04 6.109493e-03 -6.000000e+00 4.467331e-02 224.36 -2.00 3.62 -2.00 320.18 0.00e+00 6.944541e-04 2.387700e-04 3.140009e-04 -6.000000e+00 1.824246e-03 271.10 -2.00 20.00 -2.00 319.85 0.00e+00 4.189 0.001 302.00 328.00 3 2.5902e+00 2.2120e-03 4.3862e-02 -6.0000e+00 1.1104e-01 3.3998e-02 2.7157e-03 2.7227e-02 -6.0000e+00 1.2157e-01 -9.0751e-03 2.7987e-03 1.4422e-02 -6.0000e+00 7.1610e-02 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