File name: Pandora272s1_Lauder_20260330_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20260330T125434.9Z 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 v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v2d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260330_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: 20260330 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 20260329T221527.6Z 9584.927403 498 1 20.47 2 59.11 45.22 146.97 185.12 0.00 1 0.00 1 0 17 1.546e-02 8.088e-03 4.594e-03 2.213e-03 2.412397e-01 1.128307e-03 3.059640e-03 -6.000000e+00 8.882738e-03 226.60 -2.00 3.69 -2.00 316.19 0.00e+00 6.268470e-04 1.224379e-04 5.552478e-05 -6.000000e+00 3.857611e-04 278.31 -2.00 20.00 -2.00 315.58 0.00e+00 1.940 0.000 302.00 328.00 3 4.8074e+00 2.9205e-03 2.2545e-02 -6.0000e+00 2.2044e-02 3.2934e-02 3.2583e-03 1.2898e-02 -6.0000e+00 2.3912e-02 -5.1589e-03 1.8928e-03 6.3602e-03 -6.0000e+00 1.4218e-02 2.8819e-04 8.9055e-04 1.8476e-03 -6.0000e+00 6.0872e-03 5.0985e-04 -3.5737e-05 6.3343e-05 2.1843e-05 -6.0000e+00 4.2496e-04 1.9995e-02 3.7194e-05 12 9 1 12 1 1 99.81 25.46 0.22 0.01999 0.01973 9 3 1 8 0 2046.310 20.00 25.46 21.35 35.25 34.00 0.9 968.73 -2023 108 -843 -868 6995 -2626 -1136 -4993 899 -5772 -6722 -3389 -452 1356 6 527 -1457 738 -969 1923 -84 431 -615 1608 1959 2629 225 -1432 47 141 104 2371 1308 2474 -4096 -1088 -2312 -3569 303 260 -879 1660 -600 449 -81 195 -255 -552 -1760 -344 1471 1096 1222 527 1319 479 862 -1156 -440 950 1667 1348 1445 1349 167 -1023 550 -1902 641 412 845 1054 371 1087 -390 -351 -697 -1829 -1535 -1591 -1501 -518 -1981 -2591 -1035 -256 -256 282 685 104 664 88 -101 -552 262 88 -58 993 581 917 -99 -1078 -1335 -371 -331 -672 -411 -147 -416 132 408 350 409 288 232 50 -838 385 226 396 91 165 357 693 783 489 130 289 291 -26 670 -85 -405 -423 -112 8 -145 528 212 -243 -343 -415 -713 -379 22 -174 -167 1102 -437 -197 -992 186 -1348 -1566 -779 -112 376 2 169 -496 254 -352 702 -32 160 -236 636 805 1111 98 -597 18 53 41 968 582 1040 -1726 -467 -1008 -1808 163 165 -578 1111 -423 318 -57 137 -177 -374 -1179 -226 994 794 931 400 1029 383 697 -954 -354 746 1332 1152 1257 1257 159 -913 475 -1622 551 374 800 1049 375 1058 -382 -311 -592 -1470 -1250 -1438 -1434 -513 -2143 -2793 -1171 -309 -310 353 866 129 799 97 -108 -560 270 99 -68 1236 744 1169 -128 -1300 -1579 -434 -399 -866 -525 -196 -585 186 608 511 609 404 313 66 -1082 505 302 567 129 234 520 973 1038 650 165 357 377 -34 927 -123 -572 -613 -170 12 -231 855 351 -397 -542 -636 -1110 SS 20260329T222149.1Z 9584.931818 507 1 54.36 2 58.32 43.60 147.01 182.39 0.00 1 0.00 1 0 17 9.568e-03 7.046e-03 9.337e-04 5.477e-04 2.347802e-01 2.804401e-04 2.997075e-03 -6.000000e+00 5.497352e-03 226.60 -2.00 3.69 -2.00 315.60 0.00e+00 4.622822e-04 2.695708e-05 3.996730e-05 -6.000000e+00 2.386571e-04 278.31 -2.00 20.00 -2.00 315.04 0.00e+00 1.897 0.000 302.00 328.00 3 3.2866e+00 7.2093e-04 2.2015e-02 -6.0000e+00 1.3643e-02 2.4463e-02 8.0240e-04 1.2551e-02 -6.0000e+00 1.4797e-02 -1.5255e-03 4.6136e-04 6.1866e-03 -6.0000e+00 8.7984e-03 -2.2319e-03 2.1059e-04 1.7751e-03 -6.0000e+00 3.7680e-03 2.4650e-03 1.7551e-04 1.5569e-05 2.1954e-05 -6.0000e+00 2.6290e-04 1.9231e-02 9.1662e-05 11 8 0 10 0 0 99.89 25.47 0.33 0.01923 0.02055 122 13 1 8 0 445.540 20.00 25.47 21.79 35.25 34.00 0.9 971.28 -714 -436 -772 -2525 -1292 -2368 -1211 -880 270 -1860 -3220 -1917 -539 -304 473 606 -6 730 719 1648 932 705 1154 841 851 1238 368 -563 -493 472 834 1414 1431 529 -2875 -1979 -2537 -1723 -320 64 -713 -89 -692 386 -245 -92 -413 -518 -1104 -433 716 693 1028 1025 801 688 828 367 155 517 975 1201 1441 1822 575 -240 -344 -1076 24 568 541 633 317 609 161 -258 -623 -1414 -1213 -899 -1231 -1063 -1869 -2659 -1269 -590 -257 135 644 661 401 284 -184 -266 40 138 411 1018 702 348 7 -954 -1473 -553 -470 -812 -618 -492 -323 262 581 564 373 289 -108 -193 -85 76 185 469 85 275 462 412 540 610 149 513 428 226 277 16 -196 -227 46 46 -205 317 77 -100 -236 -559 -856 -179 -119 -215 -669 -299 -532 -284 -227 76 -526 -911 -545 -168 -107 175 246 -2 299 305 715 414 311 517 374 395 593 179 -260 -223 207 383 647 704 272 -1437 -949 -1328 -969 -200 42 -500 -65 -522 292 -185 -69 -307 -374 -782 -318 518 535 797 838 651 569 696 310 129 423 815 1067 1326 1717 553 -225 -297 -941 21 522 530 652 319 616 160 -241 -548 -1220 -1059 -798 -1183 -1088 -2003 -2901 -1454 -699 -310 163 786 811 474 317 -196 -276 42 154 474 1255 906 450 8 -1140 -1701 -633 -563 -1010 -801 -649 -431 368 835 809 538 403 -143 -244 -108 96 241 636 121 389 640 568 726 779 188 648 548 300 376 21 -274 -325 67 69 -311 491 122 -156 -365 -843 -1293 SS 20260329T222736.6Z 9584.935841 510 1 54.44 2 57.63 42.11 147.01 179.90 0.00 1 0.00 1 0 17 9.509e-03 7.028e-03 1.012e-03 5.976e-04 2.303673e-01 3.060922e-04 2.943664e-03 -6.000000e+00 5.463369e-03 226.60 -2.00 3.69 -2.00 315.59 0.00e+00 4.998654e-04 2.915966e-05 4.555539e-05 -6.000000e+00 2.371899e-04 278.31 -2.00 20.00 -2.00 315.02 0.00e+00 1.861 0.000 302.00 328.00 3 3.4867e+00 7.8614e-04 2.1600e-02 -6.0000e+00 1.3559e-02 2.3721e-02 8.7464e-04 1.2325e-02 -6.0000e+00 1.4706e-02 -1.8170e-03 5.0358e-04 6.0738e-03 -6.0000e+00 8.7440e-03 -1.7064e-03 2.3009e-04 1.7428e-03 -6.0000e+00 3.7446e-03 2.1033e-03 1.2925e-04 1.6987e-05 2.1995e-05 -6.0000e+00 2.6128e-04 1.9252e-02 8.4943e-05 11 8 0 10 0 0 99.48 25.47 0.31 0.01925 0.02022 122 13 1 8 0 446.200 20.00 25.47 22.35 35.25 34.00 0.9 973.62 -183 -93 -1092 -2107 -1021 -2081 -1213 -1112 178 -1949 -3203 -1846 -748 -223 485 548 -123 1049 669 1488 719 692 1007 662 722 1441 616 -618 -520 504 857 1668 1868 377 -2907 -2168 -2477 -1877 -149 95 -646 -61 -642 330 -401 -107 -361 -456 -1126 -454 746 758 790 960 788 724 804 372 66 481 933 1213 1588 1833 613 -218 -198 -1054 129 571 578 719 201 686 127 -254 -472 -1459 -1006 -954 -1138 -1265 -1815 -2595 -1188 -619 -314 310 635 480 473 210 -251 -421 -55 92 415 903 586 389 -85 -912 -1553 -497 -526 -719 -548 -413 -383 279 581 575 410 244 10 -141 -93 172 104 471 137 340 536 358 544 620 115 369 483 155 363 19 -213 -203 -31 -8 -174 275 117 -73 -216 -568 -889 -45 -25 -300 -546 -251 -495 -301 -281 49 -580 -953 -551 -227 -76 174 216 -51 442 293 626 310 295 437 303 344 706 306 -293 -227 227 378 777 933 186 -1481 -1061 -1242 -1073 -94 63 -454 -45 -485 250 -304 -81 -268 -329 -838 -333 538 583 610 780 664 593 669 311 54 409 773 1067 1443 1704 581 -201 -176 -910 114 537 578 728 207 681 124 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