File name: Pandora272s1_Lauder_20260211_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20260211T130226.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v2d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260211_L1_smca1c2d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20260211 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OoB based on session 1 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0435 305.1840 305.3244 305.4648 305.6052 305.7456 305.8860 306.0263 306.1667 306.3070 306.4473 306.5877 306.7280 306.8683 307.0086 307.1488 307.2891 307.4293 307.5696 307.7098 307.8500 307.9902 308.1304 308.2706 308.4108 308.5510 308.6911 308.8313 308.9714 309.1115 309.2516 309.3917 309.5318 309.6719 309.8119 309.9520 310.0920 310.2321 310.3721 310.5121 310.6521 310.7921 310.9320 311.0720 311.2120 311.3519 311.4918 311.6317 311.7717 311.9115 312.0514 312.1913 312.3312 312.4710 312.6109 312.7507 312.8905 313.0303 313.1701 313.3099 313.4496 313.5894 313.7292 313.8689 314.0086 314.1483 314.2880 314.4277 314.5674 314.7071 314.8467 314.9864 315.1260 315.2656 315.4052 315.5448 315.6844 315.8240 315.9636 316.1031 316.2427 316.3822 316.5217 316.6612 316.8007 316.9402 317.0797 317.2192 317.3586 317.4981 317.6375 317.7769 317.9163 318.0557 318.1951 318.3345 318.4738 318.6132 318.7525 318.8918 319.0312 319.1705 319.3097 319.4490 319.5883 319.7276 319.8668 320.0060 320.1453 320.2845 320.4237 320.5629 320.7020 320.8412 320.9804 321.1195 321.2586 321.3977 321.5368 321.6759 321.8150 321.9541 322.0932 322.2322 322.3713 322.5103 322.6493 322.7883 322.9273 323.0663 323.2052 323.3442 323.4831 323.6221 323.7610 323.8999 324.0388 324.1777 324.3166 324.4554 324.5943 324.7331 324.8719 --------------------------------------------------------------------------------------- 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 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20260210T203327.9Z 9537.856573 595 1 28.60 2 62.81 82.77 22.53 321.30 0.00 1 0.00 1 0 17 1.257e-02 7.547e-03 2.379e-03 1.123e-03 2.675660e-01 5.808987e-04 3.370386e-03 -6.000000e+00 7.338482e-03 231.00 -2.00 3.69 -2.00 316.29 0.00e+00 2.753071e-04 6.400543e-05 1.055905e-04 -6.000000e+00 3.150305e-04 279.53 -2.00 20.00 -2.00 315.66 0.00e+00 2.177 0.000 302.00 328.00 3 3.7173e+00 1.5171e-03 2.5441e-02 -6.0000e+00 1.8397e-02 3.2576e-02 1.6865e-03 1.4584e-02 -6.0000e+00 1.9884e-02 -5.8164e-03 9.7840e-04 7.0957e-03 -6.0000e+00 1.1790e-02 -9.3379e-05 4.5865e-04 1.9677e-03 -6.0000e+00 5.0082e-03 1.1617e-03 -2.8042e-05 3.2032e-05 2.3457e-05 -6.0000e+00 3.4565e-04 1.7948e-02 4.7261e-05 12 9 1 12 1 1 98.98 25.43 0.20 0.01795 0.01774 33 7 1 8 0 841.080 20.01 25.43 24.20 35.25 34.00 0.8 981.18 91 -1490 -1175 -1499 794 -2411 -3783 -4651 -899 -5551 -4128 -2420 -320 -173 678 725 -1083 1288 -23 2084 180 1064 651 1153 593 1511 190 333 -93 -393 130 2377 1498 976 -4002 -1263 -2755 -1868 156 743 -720 290 -817 309 -249 486 -314 -483 -1368 -414 798 700 844 1127 897 544 1053 84 94 549 1007 1386 1352 2080 639 -341 225 -1285 184 730 559 700 198 704 -75 -83 -657 -1319 -1121 -955 -1412 -1102 -2079 -2873 -1601 -409 -296 172 721 408 381 41 -368 -185 -28 -201 256 1123 553 578 -11 -893 -1877 -497 -286 -788 -672 -320 -224 284 588 575 486 447 -18 -97 -27 213 -8 566 200 189 508 452 598 689 -43 395 387 190 356 -5 -262 -453 33 -121 -156 302 216 -74 -143 -561 -861 17 -276 -223 -268 134 -405 -684 -941 -179 -1225 -892 -527 -76 -47 193 228 -364 440 -8 762 63 369 232 433 235 615 79 131 -34 -141 49 947 652 445 -1806 -538 -1209 -935 86 450 -462 193 -568 215 -174 336 -216 -324 -908 -272 545 485 618 870 686 425 834 67 74 425 795 1162 1173 1922 579 -305 195 -1093 160 675 548 691 199 682 -72 -75 -566 -1072 -926 -835 -1333 -1102 -2174 -3171 -1785 -486 -356 214 871 501 453 47 -385 -190 -30 -224 303 1412 727 761 -14 -1094 -2242 -583 -349 -992 -883 -425 -312 402 853 859 712 637 -25 -128 -34 280 -11 789 291 274 719 642 801 910 -57 505 501 255 504 -8 -383 -681 50 -190 -246 483 353 -118 -229 -875 -1347 SS 20260210T203838.6Z 9537.860169 598 1 54.27 2 61.91 81.79 23.10 318.76 0.00 1 0.00 1 0 17 2.913e-02 1.068e-02 4.305e-03 1.723e-03 2.575731e-01 8.872067e-04 3.214314e-03 -6.000000e+00 1.700973e-02 231.00 -2.00 3.69 -2.00 316.74 0.00e+00 -6.667754e-05 1.083851e-04 1.462112e-04 -6.000000e+00 7.304219e-04 279.53 -2.00 20.00 -2.00 316.09 0.00e+00 2.113 0.000 302.00 328.00 3 5.1255e+00 2.3293e-03 2.4602e-02 -6.0000e+00 4.2640e-02 3.4141e-02 2.5965e-03 1.4014e-02 -6.0000e+00 4.6093e-02 -7.4990e-03 1.5279e-03 6.8086e-03 -6.0000e+00 2.7329e-02 4.5672e-03 7.3297e-04 1.8907e-03 -6.0000e+00 1.1606e-02 3.0666e-04 4.6804e-05 4.9417e-05 2.1636e-05 -6.0000e+00 8.0145e-04 1.8647e-02 1.3375e-06 12 8 8 10 0 0 99.75 25.44 0.23 0.01865 0.01900 27 3 1 8 0 2009.770 20.00 25.44 24.60 35.25 34.00 0.8 982.70 5809 -6871 330 3482 14284 -3778 -6751 -12853 -897 -14439 -9267 -3679 1361 1167 294 208 -5028 1378 -3439 1369 862 3974 -1884 2249 840 2917 -864 1674 1108 -2185 -1061 3637 404 4030 -7738 2716 -1183 -2644 1311 2194 -1080 2544 -1176 60 -140 1730 1096 -79 -3125 721 1760 857 283 577 419 358 772 -917 -1113 2665 2736 2037 1142 1567 -348 -736 1624 -2603 829 833 1297 677 22 1078 -413 -649 43 -2107 -1664 -1199 -1902 -749 -2287 -3223 -1964 -519 -611 265 779 -337 201 -345 -467 -368 39 -478 -489 1472 234 1349 365 -710 -2194 86 415 -713 -377 554 -452 91 634 368 342 941 260 -209 -397 423 -150 665 27 -147 1011 298 1093 683 -583 212 239 -153 534 -306 249 -568 -110 -47 -286 408 229 64 -147 -517 -1031 801 -1066 54 513 1675 -512 -1001 -2248 -155 -2744 -1658 -700 275 244 71 55 -1462 390 -1061 416 268 1189 -612 742 295 1040 -322 572 352 -704 -357 1249 155 1545 -3136 964 -476 -1138 648 1266 -654 1555 -770 39 -91 1105 692 -49 -1961 435 1102 580 203 406 307 267 584 -706 -842 1922 2019 1614 989 1352 -309 -653 1304 -2111 673 760 1218 674 22 1046 -382 -581 35 -1616 -1294 -1032 -1732 -748 -2345 -3493 -2242 -628 -736 328 975 -414 243 -384 -508 -379 41 -519 -590 1826 317 1803 468 -856 -2651 101 498 -922 -508 734 -634 134 935 558 507 1378 353 -279 -518 564 -202 955 40 -220 1472 422 1536 917 -754 266 314 -216 746 -450 371 -873 -169 -76 -480 662 380 104 -243 -832 -1616 SS 20260210T210151.2Z 9537.876287 610 1 53.43 2 57.88 77.24 25.98 308.64 0.00 1 0.00 1 0 17 2.668e-02 1.161e-02 3.960e-03 1.852e-03 2.306977e-01 9.564068e-04 2.890108e-03 -6.000000e+00 1.557499e-02 231.00 -2.00 3.69 -2.00 316.31 0.00e+00 5.898646e-05 1.057434e-04 1.001858e-04 -6.000000e+00 6.688516e-04 279.53 -2.00 20.00 -2.00 315.67 0.00e+00 1.874 0.000 302.00 328.00 3 5.5027e+00 2.5005e-03 2.1895e-02 -6.0000e+00 3.9043e-02 3.9021e-02 2.7803e-03 1.2535e-02 -6.0000e+00 4.2205e-02 -9.0934e-03 1.6142e-03 6.0951e-03 -6.0000e+00 2.5024e-02 5.0010e-03 7.5575e-04 1.6901e-03 -6.0000e+00 1.0627e-02 2.7462e-04 1.1060e-04 5.3085e-05 2.0059e-05 -6.0000e+00 7.3390e-04 1.7941e-02 -3.2404e-05 12 8 8 10 0 0 93.14 25.44 0.03 0.01794 0.01877 15 2 1 8 0 3561.580 19.99 25.44 26.15 35.25 33.75 0.8 989.26 5002 -6247 2378 149 11838 -2320 -5978 -11512 -708 -12367 -7934 -4207 1654 1451 177 1148 -5403 1333 -3651 2186 8 3558 -1843 1335 756 3287 -932 3935 1294 -1827 -1465 2776 1718 4729 -7422 3027 -1554 -2496 982 1995 -501 2638 -1097 230 145 1490 706 -120 -3154 1229 1274 601 70 434 521 -218 748 -1129 -1437 2494 3068 2145 664 1746 240 -1035 1821 -2826 962 783 988 667 -302 957 -367 -940 -296 -1608 -1881 -1233 -2064 -929 -2426 -3182 -1679 -321 -44 -391 945 -85 171 -658 -385 54 -138 -859 -228 1589 516 2039 485 -927 -2611 22 543 -981 -218 546 -383 -123 881 542 136 795 623 -500 -539 334 -475 802 -93 -107 1101 281 1148 929 -649 96 166 69 618 -40 76 -773 -51 24 -230 279 159 -70 78 -690 -1040 824 -1247 443 26 1817 -394 -1115 -2283 -140 -2885 -1746 -906 372 369 51 361 -1885 448 -1337 779 3 1257 -702 519 308 1354 -368 1516 471 -671 -562 1084 728 2008 -3055 1189 -695 -1186 537 1171 -331 1759 -782 164 103 1035 484 -81 -2125 787 853 432 53 322 400 -171 591 -910 -1139 1883 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