File name: Pandora272s1_Lauder_20251213_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T064546.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 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_v6d20241202.txt Level 1 file used: Pandora272s1_Lauder_20251213_L1_smca1c6d20241202p1-8.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: 20251213 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: None First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0455 305.1861 305.3267 305.4672 305.6077 305.7483 305.8888 306.0293 306.1697 306.3102 306.4507 306.5911 306.7315 306.8720 307.0124 307.1528 307.2931 307.4335 307.5739 307.7142 307.8545 307.9949 308.1352 308.2755 308.4158 308.5560 308.6963 308.8365 308.9768 309.1170 309.2572 309.3974 309.5376 309.6778 309.8179 309.9581 310.0982 310.2383 310.3784 310.5185 310.6586 310.7987 310.9388 311.0788 311.2189 311.3589 311.4989 311.6389 311.7789 311.9189 312.0589 312.1988 312.3388 312.4787 312.6186 312.7585 312.8984 313.0383 313.1782 313.3180 313.4579 313.5977 313.7375 313.8773 314.0171 314.1569 314.2967 314.4364 314.5762 314.7159 314.8556 314.9954 315.1351 315.2747 315.4144 315.5541 315.6937 315.8334 315.9730 316.1126 316.2522 316.3918 316.5314 316.6710 316.8105 316.9501 317.0896 317.2291 317.3686 317.5081 317.6476 317.7871 317.9265 318.0660 318.2054 318.3448 318.4842 318.6236 318.7630 318.9024 319.0417 319.1811 319.3204 319.4598 319.5991 319.7384 319.8777 320.0169 320.1562 320.2955 320.4347 320.5739 320.7131 320.8523 320.9915 321.1307 321.2699 321.4090 321.5482 321.6873 321.8264 321.9655 322.1046 322.2437 322.3828 322.5219 322.6609 322.7999 322.9390 323.0780 323.2170 323.3560 323.4949 323.6339 323.7729 323.9118 324.0507 324.1896 324.3285 324.4674 324.6063 324.7452 324.8840 --------------------------------------------------------------------------------------- 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 20251212T193011.5Z 9477.812633 763 1 54.55 2 64.39 97.85 43.53 355.59 0.00 1 0.00 1 0 17 2.446e-02 8.442e-03 3.729e-03 1.329e-03 2.857094e-01 6.858443e-04 3.559382e-03 -6.000000e+00 1.432052e-02 231.70 -2.00 3.69 -2.00 316.96 0.00e+00 1.770738e-04 8.762188e-05 1.391988e-04 -6.000000e+00 6.077843e-04 277.40 -2.00 20.00 -2.00 316.33 0.00e+00 2.299 0.000 302.00 328.00 3 4.7392e+00 1.8133e-03 2.6947e-02 -6.0000e+00 3.5988e-02 3.9183e-02 2.0216e-03 1.5608e-02 -6.0000e+00 3.8893e-02 -1.1298e-02 1.2021e-03 7.5900e-03 -6.0000e+00 2.3019e-02 4.0843e-03 5.8287e-04 2.1039e-03 -6.0000e+00 9.7395e-03 3.6388e-04 8.7054e-05 3.8146e-05 2.3965e-05 -6.0000e+00 6.7284e-04 5.4676e-03 0.0000e+00 11 8 0 10 0 0 99.97 25.35 0.33 0.00547 0.00612 72 7 1 8 0 757.270 20.00 25.35 22.52 35.25 33.75 0.9 974.42 -4908 2113 -1927 1201 13075 -4135 -5355 -11891 -445 -9892 -8256 -5211 2348 -683 -3553 -73 -2693 2976 -1281 1923 -510 2190 -704 1339 1067 2915 324 2713 -197 -539 -1436 2146 1132 3594 -6765 905 -3232 -2568 -770 542 -802 1335 -1312 257 180 1324 32 745 -2423 24 2117 989 915 387 419 328 915 -114 -783 1988 1803 1550 1337 1746 133 -728 1045 -1951 378 444 451 717 -79 1005 68 -85 -452 -1347 -1572 -1218 -1383 -837 -1609 -2477 -1330 -491 -451 -37 487 -40 129 27 -90 -459 -452 -143 88 1305 622 1014 -54 -930 -2303 -138 332 -661 -513 -29 -577 162 564 387 182 476 17 83 -362 251 -61 655 194 120 786 366 770 575 -188 394 66 127 391 102 -98 -559 -20 -77 129 318 236 -135 -326 -550 -798 -619 274 -269 154 1320 -475 -660 -1737 -65 -1684 -1379 -866 406 -127 -779 -17 -687 747 -351 529 -147 609 -206 408 342 955 110 853 -59 -160 -456 709 410 1330 -2406 315 -1167 -1060 -373 283 -470 805 -779 153 115 834 20 455 -1503 14 1323 624 612 275 311 249 703 -88 -601 1468 1365 1171 1100 1540 113 -625 819 -1531 300 396 419 702 -79 960 62 -74 -357 -1080 -1289 -1036 -1248 -836 -1648 -2682 -1518 -565 -548 -46 618 -50 149 30 -93 -477 -486 -159 102 1671 821 1335 -68 -1164 -2709 -158 410 -833 -675 -40 -797 236 829 587 271 701 24 110 -472 334 -87 943 291 179 1144 516 1077 769 -254 518 87 179 554 152 -149 -877 -31 -129 212 531 403 -228 -528 -905 -1273 SS 20251212T193110.2Z 9477.813312 765 1 3.14 2 64.22 97.68 43.54 355.24 0.00 1 0.00 1 0 17 1.061e-02 6.928e-03 5.468e-03 2.556e-03 2.817984e-01 1.326025e-03 3.522888e-03 -6.000000e+00 6.213365e-03 231.70 -2.00 3.69 -2.00 316.34 0.00e+00 5.300615e-04 1.456590e-04 7.964060e-05 -6.000000e+00 2.636366e-04 277.40 -2.00 20.00 -2.00 315.73 0.00e+00 2.285 0.000 302.00 328.00 3 3.2047e+00 3.4707e-03 2.6691e-02 -6.0000e+00 1.5615e-02 2.9631e-02 3.8545e-03 1.5363e-02 -6.0000e+00 1.6873e-02 -4.6196e-03 2.2390e-03 7.4603e-03 -6.0000e+00 9.9865e-03 -8.5549e-04 1.0476e-03 2.0926e-03 -6.0000e+00 4.2269e-03 1.7250e-03 1.8731e-04 7.2566e-05 2.4247e-05 -6.0000e+00 2.9181e-04 3.3677e-03 0.0000e+00 12 9 1 12 1 1 -278.45 25.35 0.34 0.00337 0.00478 6 13 1 8 0 435.280 20.00 25.35 22.52 35.00 34.00 0.9 974.42 -740 -1007 -1976 -1096 -1223 -1355 -2538 -4072 -1129 -2826 -3130 -1963 -1064 160 -594 1950 431 1736 1298 969 761 1178 817 429 1526 841 1040 564 -1075 -792 161 1457 777 -22 -2763 -2018 -2693 -1386 -220 -238 -757 -128 -1273 -29 -570 250 -28 -296 -1245 -612 601 458 1031 1280 1283 345 1065 354 588 700 718 1194 1609 1484 773 253 -82 -715 44 -42 839 820 130 737 60 -175 -147 -1355 -1113 -1171 -1424 -1298 -1751 -2248 -787 -348 -326 354 757 557 388 302 -498 -516 -101 -503 396 924 724 212 -112 -829 -1750 -683 -315 -555 -794 -332 -258 342 297 494 376 434 -182 -470 114 16 224 694 59 183 591 571 477 486 -148 572 475 401 257 -12 -427 -373 288 33 225 343 123 -366 -208 -635 -850 -126 -190 -389 -203 -202 -214 -429 -775 -232 -630 -699 -444 -247 42 -168 600 142 589 431 335 270 413 294 164 605 327 409 225 -405 -293 63 604 330 -10 -1206 -846 -1233 -678 -120 -145 -490 -82 -857 -19 -386 168 -19 -193 -846 -414 402 330 746 978 977 270 845 284 461 543 570 964 1407 1343 716 221 -69 -590 37 -38 814 809 131 713 57 -157 -123 -1127 -942 -1059 -1345 -1312 -1856 -2423 -891 -408 -391 424 917 681 456 337 -532 -542 -105 -557 467 1136 936 276 -143 -1026 -2094 -804 -386 -707 -1027 -449 -355 483 435 724 556 622 -249 -616 149 21 302 972 86 266 840 809 659 639 -193 721 631 555 367 -18 -618 -553 435 52 363 553 203 -596 -333 -990 -1320 SS 20251212T193233.0Z 9477.814271 767 1 4.62 2 63.98 97.46 43.55 354.74 0.00 1 0.00 1 0 17 1.045e-02 7.173e-03 2.423e-03 1.212e-03 2.805122e-01 6.294674e-04 3.525295e-03 -6.000000e+00 6.118178e-03 231.70 -2.00 3.69 -2.00 316.18 0.00e+00 5.853506e-04 6.664948e-05 6.585976e-05 -6.000000e+00 2.595807e-04 277.40 -2.00 20.00 -2.00 315.58 0.00e+00 2.266 0.000 302.00 328.00 3 2.2872e+00 1.6447e-03 2.6516e-02 -6.0000e+00 1.5375e-02 2.5290e-02 1.8252e-03 1.5315e-02 -6.0000e+00 1.6614e-02 -8.0461e-03 1.0550e-03 7.4429e-03 -6.0000e+00 9.8333e-03 1.2444e-03 4.8891e-04 2.0978e-03 -6.0000e+00 4.1626e-03 4.4165e-03 1.2201e-04 3.4429e-05 2.4630e-05 -6.0000e+00 2.8730e-04 2.6643e-03 0.0000e+00 12 9 1 12 1 1 58.03 25.36 0.34 0.00266 0.00358 27 34 1 8 0 164.710 20.01 25.36 22.65 35.25 33.75 0.9 974.79 -1278 -1114 145 -819 -1219 -4287 -2513 -1458 328 -1826 -2588 -2498 -1257 -148 593 383 601 421 1237 1035 1208 669 1543 1043 666 905 336 -55 -868 41 650 708 1271 138 -2379 -2849 -3043 -2369 -860 -210 -772 -332 -561 606 -51 116 -357 -167 -878 -126 682 640 1019 1225 855 971 794 876 262 461 722 1095 1802 1833 825 75 -57 -1142 -235 721 666 553 492 532 186 -379 -722 -1322 -1141 -1034 -1201 -1378 -1989 -2553 -1179 -567 -200 391 551 623 356 399 -149 -451 -289 -34 479 1110 623 85 -245 -927 -1618 -781 -463 -750 -561 -395 -370 283 456 626 466 309 -311 -148 46 62 354 382 83 286 467 334 536 723 129 344 406 427 220 115 -17 -214 157 60 -185 387 78 -167 -342 -435 -1093 -241 -231 31 -166 -221 -831 -466 -296 73 -442 -630 -577 -322 -43 183 124 205 150 456 374 444 246 574 413 278 369 139 -23 -340 16 262 308 563 65 -1084 -1260 -1462 -1231 -475 -130 -511 -220 -386 418 -36 80 -245 -112 -582 -83 468 453 761 931 679 756 632 698 206 372 573 923 1582 1671 747 67 -48 -952 -201 662 636 541 487 527 179 -344 -613 -1099 -965 -938 -1150 -1379 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