File name: Pandora21s1_Bremen_20210801_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T083538.9Z 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_20210801_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: 20210801 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 20210801T082941.0Z 7883.353947 345 1 4.48 2 49.64 117.32 49.76 235.54 0.00 1 0.00 1 0 25 1.075e-02 6.226e-03 5.640e-03 2.859e-03 2.341916e-01 1.526907e-03 3.145387e-03 -6.000000e+00 6.531375e-03 233.27 -2.00 3.88 -2.00 316.06 0.00e+00 1.163084e-05 1.470702e-04 3.656599e-05 -6.000000e+00 2.575491e-04 282.77 -2.00 20.00 -2.00 315.75 0.00e+00 1.541 0.000 302.00 328.00 3 4.2313e+00 4.0093e-03 2.0739e-02 -6.0000e+00 1.6556e-02 5.4038e-04 4.4395e-03 1.3615e-02 -6.0000e+00 1.7922e-02 3.0334e-03 2.5529e-03 6.6440e-03 -6.0000e+00 1.0490e-02 -1.9006e-03 1.1515e-03 1.8357e-03 -6.0000e+00 4.3007e-03 1.2524e-03 -3.0026e-04 8.7756e-05 2.5186e-05 -6.0000e+00 3.2332e-04 -3.2868e-04 -2.6798e-05 12 1 1 12 1 1 92.37 22.32 0.22 -0.00033 -0.00258 5 14 1 5 0 717.842 25.39 19.99 22.32 24.79 26.5 999.00 -564 -5020 -1312 -6147 -427 -3545 2560 -584 609 -1551 374 778 -110 925 192 1646 -539 1237 6 1124 531 135 1342 714 515 354 445 -799 299 633 1888 807 463 -31 -2185 -743 -786 1558 -881 -1160 -1442 -692 -367 -1482 -706 -204 397 -1559 -296 952 539 726 1032 1026 357 1538 934 281 433 1009 704 1339 886 304 -307 -493 69 514 738 -351 69 -575 41 -455 91 -297 -266 830 346 209 -564 -799 -1416 -1092 -1121 -887 -472 -568 -260 -350 510 314 988 1143 655 248 774 196 -464 -225 -427 -73 429 475 -1109 -643 -175 -386 185 229 -8 -146 4 -157 161 288 553 376 24 -248 -853 -322 -560 98 466 693 944 1062 818 493 751 116 130 230 66 -175 77 18 -371 -176 -468 -514 -408 -111 -1094 -281 -1307 -80 -661 473 -121 136 -367 87 186 -29 264 61 549 -190 442 2 423 204 52 522 289 217 153 192 -335 119 247 750 341 205 -14 -979 -326 -364 789 -512 -745 -988 -488 -263 -1079 -511 -147 282 -1100 -205 654 381 534 786 806 287 1249 769 233 355 824 586 1153 801 285 -289 -448 60 435 643 -328 68 -586 41 -458 88 -272 -229 685 290 186 -541 -814 -1510 -1200 -1278 -1051 -577 -708 -325 -431 602 353 1050 1182 692 276 910 244 -602 -292 -539 -88 501 559 -1368 -821 -228 -518 254 325 -11 -215 6 -221 216 372 705 488 32 -347 -1220 -460 -791 135 625 904 1197 1334 1053 659 1032 163 184 332 98 -268 121 29 -591 -278 -731 -787 -616 SS 20210801T084437.0Z 7883.364317 352 1 38.52 2 47.69 121.27 51.58 239.45 0.00 1 0.00 1 0 17 9.310e-03 4.785e-03 7.956e-03 2.743e-03 2.343027e-01 1.449318e-03 3.118771e-03 -6.000000e+00 5.656299e-03 233.27 -2.00 3.88 -2.00 317.20 0.00e+00 -5.026273e-05 1.813134e-04 5.196142e-05 -6.000000e+00 2.230514e-04 282.77 -2.00 20.00 -2.00 316.87 0.00e+00 1.483 0.000 302.00 328.00 3 5.6028e+00 3.8505e-03 2.0347e-02 -6.0000e+00 1.4338e-02 4.1670e-02 4.2795e-03 1.3634e-02 -6.0000e+00 1.5521e-02 2.8942e-03 2.5599e-03 6.6735e-03 -6.0000e+00 9.0850e-03 -3.2518e-03 1.2255e-03 1.8611e-03 -6.0000e+00 3.7243e-03 3.2962e-04 -3.2512e-04 8.6034e-05 2.3705e-05 -6.0000e+00 2.8001e-04 3.2993e-04 -1.6329e-05 12 1 1 12 1 1 99.99 22.33 0.19 0.00033 -0.00211 38 10 1 5 0 983.241 25.39 20.00 22.33 26.08 26.7 1003.54 2146 -4238 -556 -1734 -261 -407 -586 -3950 567 -2245 -934 -1379 -308 2255 -1104 1571 1 1616 601 -979 1506 -224 1309 -2364 -1076 -1661 441 1555 1801 168 1031 1255 801 -549 -964 477 -928 1334 -787 -455 -670 -344 -696 -851 29 -1034 -222 -795 -195 447 465 182 317 161 374 1016 538 983 83 1095 834 952 759 173 536 -462 114 131 1141 127 -225 -415 -208 29 232 508 -374 729 -335 -162 -812 -1058 -1221 -957 -793 -1023 -14 62 252 24 212 370 409 518 446 1150 390 516 -272 -437 -475 -478 244 323 -694 -568 -574 -161 87 92 411 163 -27 -206 -54 311 51 247 -115 -220 -486 7 -234 -113 355 111 843 769 422 -15 309 92 205 260 97 59 333 326 -419 -112 -546 -209 -369 256 -580 -74 -223 -30 -46 -69 -530 80 -340 -140 -214 -52 416 -235 354 0 394 153 -260 399 -61 355 -694 -328 -525 136 451 493 45 287 373 254 -180 -306 147 -311 503 -354 -233 -375 -201 -418 -518 17 -627 -131 -461 -110 252 272 113 206 110 262 721 389 708 60 777 607 731 622 150 462 -380 87 97 879 108 -207 -400 -202 28 207 416 -283 519 -245 -129 -716 -1015 -1246 -1020 -890 -1217 -18 78 321 31 250 405 416 506 447 1229 456 653 -364 -587 -613 -579 281 376 -860 -741 -779 -225 126 140 647 260 -42 -307 -75 410 67 328 -161 -324 -739 11 -349 -164 492 148 1075 968 551 -21 443 136 306 398 156 98 569 568 -739 -195 -933 -346 -600 SS 20210801T084920.4Z 7883.367597 355 1 53.13 2 47.09 122.56 52.17 240.65 0.00 1 0.00 1 0 25 7.207e-03 5.173e-03 6.952e-04 2.647e-04 2.227262e-01 1.395109e-04 2.976772e-03 -6.000000e+00 4.378940e-03 233.27 -2.00 3.88 -2.00 316.96 0.00e+00 5.663739e-05 1.644263e-05 4.487308e-05 -6.000000e+00 1.726551e-04 282.77 -2.00 20.00 -2.00 316.62 0.00e+00 1.466 0.000 302.00 328.00 3 1.5622e+00 3.7009e-04 1.9744e-02 -6.0000e+00 1.1100e-02 3.7876e-03 4.1111e-04 1.2975e-02 -6.0000e+00 1.2016e-02 6.5742e-03 2.4231e-04 6.3385e-03 -6.0000e+00 7.0331e-03 -5.0477e-03 1.1400e-04 1.7583e-03 -6.0000e+00 2.8835e-03 1.9802e-02 -1.4911e-04 8.2720e-06 2.3159e-05 -6.0000e+00 2.1674e-04 9.7982e-05 1.9141e-05 10 0 0 10 0 0 99.95 22.33 0.23 0.00010 -0.00102 2374 466 1 5 0 20.732 25.39 20.00 22.33 26.16 26.6 1003.39 -1115 -2520 -2027 -2737 -911 -1027 -17 346 -310 -109 -421 638 -506 139 -791 -481 -376 189 311 44 457 534 1049 312 459 -170 -310 -129 991 1477 1095 1613 201 -616 -746 -63 -665 -133 -487 -1013 -970 -969 -859 -843 -507 -859 -555 -753 -145 458 558 813 754 787 529 870 539 565 837 1062 1281 1174 1128 309 -55 94 261 597 894 348 -230 -264 -388 -325 -239 131 217 613 536 -82 -607 -1165 -1373 -1126 -914 -878 -409 -394 -205 -212 160 217 679 1042 885 750 736 337 -443 -489 -427 -451 283 194 -491 -557 -465 -370 99 65 28 -120 -118 -51 132 564 487 505 119 -322 -567 -224 -282 -2 359 351 973 1029 753 441 278 79 201 407 -16 -65 20 -9 -416 -201 -370 -349 -233 -156 -387 -313 -401 -119 -129 -2 50 -49 -18 -70 108 -94 29 -187 -123 -101 52 88 13 136 159 316 99 152 -59 -106 -42 298 430 331 518 70 -219 -255 -21 -240 -55 -225 -542 -569 -597 -543 -538 -322 -544 -343 -453 -85 265 336 518 508 555 385 645 407 426 621 783 968 944 974 266 -47 81 208 458 714 310 -212 -255 -378 -307 -212 112 168 444 396 -67 -556 -1107 -1401 -1210 -1042 -1070 -494 -493 -257 -259 193 239 683 1063 871 802 869 412 -582 -643 -534 -557 328 229 -621 -707 -618 -513 144 99 42 -185 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