File name: Pandora21s1_Bremen_20210628_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T075624.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20210628_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20210628 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: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 --------------------------------------------------------------------------------------- SS 20210628T073454.6Z 7849.315909 304 1 4.56 2 52.72 100.78 94.56 244.09 0.00 1 0.00 1 0 17 1.039e-02 5.775e-03 6.319e-03 3.119e-03 2.413501e-01 1.668608e-03 3.210602e-03 -6.000000e+00 6.323196e-03 233.80 -2.00 3.88 -2.00 316.12 0.00e+00 1.060062e-04 1.628471e-04 3.941460e-05 -6.000000e+00 2.488322e-04 281.16 -2.00 20.00 -2.00 315.81 0.00e+00 1.647 0.000 302.00 328.00 3 4.2555e+00 4.3896e-03 2.1787e-02 -6.0000e+00 1.6049e-02 2.3902e-02 4.8595e-03 1.4007e-02 -6.0000e+00 1.7366e-02 -3.5748e-06 2.7972e-03 6.8177e-03 -6.0000e+00 1.0161e-02 -3.4457e-03 1.2652e-03 1.8800e-03 -6.0000e+00 4.1614e-03 1.0816e-03 3.4457e-05 9.5855e-05 2.5357e-05 -6.0000e+00 3.1241e-04 1.4664e-04 2.6408e-05 12 1 1 12 9 1 79.95 22.53 0.18 0.00015 0.00041 4 11 1 5 0 877.762 25.58 20.00 22.53 29.08 25.2 1017.12 1019 -4837 -3476 -1593 -758 1773 -2699 1526 689 -68 -1190 4888 -1914 -564 -1009 -1603 -392 1011 1053 -257 1416 -493 1230 613 298 -483 -439 970 -973 2566 1428 1627 772 469 -634 -118 -964 -990 281 -690 -331 -1139 -575 -505 -365 -965 -527 -1074 -1196 581 681 1549 187 1276 189 761 70 610 529 814 1453 724 791 -105 325 198 271 -63 1105 520 -83 -138 -911 211 -570 -29 821 371 -73 -14 -464 -1647 -1198 -1059 -1110 -632 -218 -259 -362 -98 323 81 32 368 694 1221 180 539 -285 -231 87 -297 252 122 -508 -546 -572 -375 369 11 97 106 -177 -107 -107 661 44 420 20 -154 -656 -448 -121 38 510 450 1392 876 499 454 485 140 -96 -14 42 136 -71 84 -358 -181 -636 -234 -281 190 -1015 -731 -314 -138 305 -503 301 148 -15 -273 1095 -490 -159 -314 -536 -135 355 380 -96 531 -188 470 244 124 -207 -187 394 -384 971 562 674 338 209 -278 -51 -443 -506 161 -438 -223 -799 -410 -362 -262 -693 -374 -751 -828 398 479 1130 143 998 152 619 57 502 433 663 1199 624 713 -99 305 179 234 -54 961 484 -82 -141 -934 211 -552 -26 700 306 -62 -12 -445 -1686 -1276 -1165 -1266 -748 -267 -323 -452 -121 381 90 34 382 733 1352 213 671 -369 -300 110 -359 295 144 -625 -696 -750 -504 507 16 142 156 -258 -151 -143 853 56 547 27 -216 -939 -641 -171 53 684 588 1760 1102 644 608 670 197 -137 -21 63 209 -111 133 -572 -288 -996 -359 -425 SS 20210628T074034.5Z 7849.319844 308 1 50.69 2 51.88 102.04 95.29 245.16 0.00 1 0.00 1 0 25 6.678e-03 4.506e-03 2.535e-03 7.800e-04 2.337874e-01 4.120636e-04 3.104746e-03 -6.000000e+00 4.064962e-03 233.80 -2.00 3.88 -2.00 317.53 0.00e+00 2.652053e-05 5.548210e-05 5.618120e-05 -6.000000e+00 1.599893e-04 281.16 -2.00 20.00 -2.00 317.19 0.00e+00 1.616 0.000 302.00 328.00 3 3.0723e+00 1.1005e-03 2.1316e-02 -6.0000e+00 1.0317e-02 5.7952e-03 1.2237e-03 1.3662e-02 -6.0000e+00 1.1165e-02 9.7362e-03 7.4224e-04 6.6827e-03 -6.0000e+00 6.5322e-03 -7.6024e-03 3.6060e-04 1.8682e-03 -6.0000e+00 2.6748e-03 3.7080e-03 -1.0487e-04 2.4799e-05 2.3419e-05 -6.0000e+00 2.0088e-04 1.6179e-03 3.0385e-05 10 0 0 10 0 0 99.99 22.53 0.13 0.00162 0.00083 999 196 1 5 0 49.835 25.58 20.00 22.53 29.43 25.5 1020.61 -1273 -1763 -1418 -2553 969 -456 1017 193 124 632 -154 261 -3 783 -890 -73 -776 202 40 103 666 53 1155 -102 806 -301 165 -491 613 510 1096 1392 390 -370 -1087 -315 -824 169 -467 -966 -1200 -1068 -920 -1186 -543 -1036 -719 -903 -259 283 485 553 589 661 367 870 550 789 624 922 1284 1328 1169 489 129 47 336 321 961 374 -61 -39 -156 -192 5 224 -33 585 106 -66 -619 -1051 -1369 -1117 -830 -768 -270 -231 -63 -12 257 267 506 935 723 659 642 427 -368 -255 -322 -402 -3 111 -498 -601 -476 -395 23 102 157 -112 -83 -44 47 355 241 362 145 -227 -531 -71 -260 -14 304 277 769 891 678 322 325 80 200 219 -10 -93 21 90 -268 -136 -255 -266 -277 -139 -209 -170 -292 98 -45 103 22 15 82 -20 35 0 131 -170 -15 -169 45 9 25 161 13 284 -27 219 -85 46 -131 153 124 275 373 112 -110 -312 -88 -250 59 -195 -467 -611 -571 -505 -659 -300 -596 -404 -495 -138 150 268 324 366 429 237 595 383 548 429 629 896 986 896 398 105 36 249 230 718 299 -54 -36 -145 -173 4 179 -24 398 74 -51 -535 -962 -1350 -1159 -915 -905 -335 -297 -81 -16 299 285 493 906 723 687 740 542 -501 -347 -417 -483 -3 128 -614 -791 -656 -546 33 154 251 -182 -131 -66 67 471 314 485 207 -333 -811 -108 -388 -20 431 373 983 1121 890 452 481 123 312 338 -17 -159 38 164 -493 -247 -450 -454 -461 SS 20210628T074507.8Z 7849.323008 311 1 50.50 2 51.22 103.07 95.88 246.03 0.00 1 0.00 1 0 25 6.912e-03 4.857e-03 9.075e-04 3.360e-04 2.294675e-01 1.776749e-04 3.058557e-03 -6.000000e+00 4.207326e-03 233.80 -2.00 3.88 -2.00 316.98 0.00e+00 1.277659e-04 2.109475e-05 4.773902e-05 -6.000000e+00 1.656012e-04 281.16 -2.00 20.00 -2.00 316.64 0.00e+00 1.593 0.000 302.00 328.00 3 2.0840e+00 4.7156e-04 2.0961e-02 -6.0000e+00 1.0679e-02 -8.7660e-04 5.2329e-04 1.3401e-02 -6.0000e+00 1.1556e-02 2.9210e-03 3.0960e-04 6.5367e-03 -6.0000e+00 6.7611e-03 -3.0528e-03 1.4627e-04 1.8120e-03 -6.0000e+00 2.7683e-03 1.0320e-02 -1.9243e-04 1.0502e-05 2.3458e-05 -6.0000e+00 2.0793e-04 1.7296e-03 1.8588e-05 10 0 0 10 0 0 99.95 22.54 0.18 0.00173 0.00028 861 169 1 5 0 57.831 25.58 20.00 22.54 29.97 25.6 1024.10 -2082 -1700 -2596 -2319 -1279 -889 -407 257 86 -981 -321 -13 -451 -249 -415 -515 -264 -6 286 231 215 890 800 289 400 1 -342 70 923 1258 1104 1254 565 -599 -515 -265 -632 -271 -498 -893 -880 -772 -951 -760 -550 -728 -610 -737 -210 328 509 693 846 726 628 782 554 558 732 963 1101 1286 1107 447 20 166 71 415 781 342 -107 -116 -194 -358 -119 67 102 345 275 -185 -559 -1112 -1381 -1086 -947 -793 -400 -297 -115 -101 237 176 611 888 793 636 770 342 -309 -432 -373 -469 154 113 -574 -518 -550 -388 -2 23 11 -89 -113 -78 101 451 422 415 167 -218 -459 -94 -192 44 373 381 928 1028 743 560 307 96 154 333 -19 -133 62 -71 -307 -200 -317 -411 -306 -282 -248 -386 -324 -161 -107 -51 36 13 -158 -51 -2 -82 -51 -95 -128 -69 -2 79 66 63 258 236 90 131 0 -115 22 273 362 329 400 193 -211 -174 -88 -227 -112 -246 -474 -512 -471 -597 -481 -347 -458 -376 -442 -123 190 307 443 571 514 459 584 420 423 547 715 840 1041 902 386 18 144 57 323 635 289 -100 -113 -190 -342 -107 59 80 256 209 -154 -489 -1077 -1439 -1190 -1035 -926 -492 -379 -147 -125 274 199 629 872 802 700 877 430 -416 -584 -478 -559 185 138 -704 -676 -752 -555 -3 34 18 -141 -174 -113 143 594 544 551 236 -311 -681 -139 -279 65 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