File name: Pandora25s1_HoustonTX_20240420_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240928T004848.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20240420_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20240420 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 20240420T124633.6Z 8876.532333 187 1 49.33 2 78.53 82.86 122.64 297.74 0.00 1 0.00 1 0 17 3.505e-01 1.189e-02 9.796e-02 3.125e-03 6.146044e-01 1.673304e-03 6.574829e-03 -6.000000e+00 2.049418e-01 229.74 -2.00 3.24 -2.00 320.70 0.00e+00 1.971716e-03 6.962047e-04 1.362055e-03 -6.000000e+00 9.199659e-03 288.38 -2.00 20.00 -2.00 320.03 0.00e+00 4.859 0.001 302.00 328.00 3 2.8122e+00 5.3592e-03 5.7185e-02 -6.0000e+00 5.1212e-01 8.1026e-02 6.9391e-03 3.0929e-02 -6.0000e+00 5.5466e-01 -1.3183e-01 6.2874e-03 1.5780e-02 -6.0000e+00 3.2833e-01 4.9921e-02 3.0981e-03 4.7096e-03 -6.0000e+00 1.3942e-01 1.3025e-04 -8.5324e-04 8.7557e-05 6.0408e-05 -6.0000e+00 9.6827e-03 -3.6066e-02 1.7366e-04 12 8 8 10 0 0 98.79 24.40 0.21 -0.03607 -0.04248 52 11 1 5 0 948.530 26.94 20.00 24.40 30.60 31.7 1100.00 -127829 -16544 -133811 279 -144506 -141874 900000 -142329 900000 -126777 -135318 31470 -86871 -36406 -34206 -98771 -18284 24204 -15442 -10984 -10772 -23730 -15799 -10447 -35253 -2754 -18575 -3383 -15069 -33040 43260 5600 9614 -1174 -10146 13924 25940 65436 9059 -2349 -187 11051 1620 9316 12273 7122 -8399 -1942 12721 4645 6630 3138 3344 5532 5015 4369 6631 -5352 1345 -788 5526 -470 1035 2481 2652 -401 -386 1028 3657 2734 2938 2722 500 -846 3229 2025 -5222 -1337 -707 931 -1087 -1420 -1758 -409 -901 -2066 275 -276 -484 992 765 606 99 -1081 -1613 -147 -708 -12 140 -990 78 -1836 -1698 -1607 185 -830 -1143 -982 171 444 255 831 524 566 -14 644 -170 -245 -336 70 -329 512 604 662 116 1201 138 789 356 18 623 -67 -265 581 -258 -178 -89 275 -221 -243 362 -795 -423 -1819 -97 -2484 1 -2665 -2522 900000 -3114 900000 -2921 -3519 197 -1993 -658 -744 -4522 -451 444 -437 -315 -316 -787 -510 -349 -1588 -98 -773 -119 -581 -1598 1215 259 490 -71 -641 700 1279 2646 740 -252 -22 1258 211 1158 1505 934 -1296 -290 1728 721 1111 603 699 1225 1181 1077 1649 -1488 344 -203 1380 -135 328 863 967 -147 -139 374 1415 1209 1423 1380 258 -423 1447 835 -2147 -531 -305 457 -624 -918 -1236 -299 -702 -1720 234 -243 -429 847 620 464 73 -818 -1331 -134 -731 -14 171 -1235 92 -2054 -1770 -1666 200 -950 -1367 -1233 227 637 395 1342 853 901 -21 951 -252 -373 -536 116 -547 829 953 1020 174 1741 197 1132 553 31 1126 -128 -522 1183 -554 -396 -203 630 -510 -551 789 -1679 -868 SS 20240420T125235.9Z 8876.536526 190 1 49.56 2 77.22 83.57 123.77 298.83 0.00 1 0.00 1 0 17 2.582e-01 7.992e-03 1.474e-01 2.875e-03 5.657867e-01 1.536192e-03 5.999135e-03 -6.000000e+00 1.514360e-01 229.74 -2.00 3.24 -2.00 320.41 0.00e+00 -8.451730e-05 5.887391e-04 4.047125e-04 -6.000000e+00 6.811944e-03 288.38 -2.00 20.00 -2.00 319.71 0.00e+00 4.399 0.001 302.00 328.00 3 3.1829e+00 4.7541e-03 5.1851e-02 -6.0000e+00 3.7854e-01 -3.2086e-03 6.0738e-03 2.7918e-02 -6.0000e+00 4.1045e-01 -3.9706e-03 5.5410e-03 1.3831e-02 -6.0000e+00 2.4282e-01 -5.7783e-03 2.7775e-03 4.0149e-03 -6.0000e+00 1.0358e-01 1.4796e-04 -5.8815e-04 8.2569e-05 4.4426e-05 -6.0000e+00 7.1971e-03 -3.6483e-02 1.9705e-04 11 9 0 11 8 0 99.68 24.40 0.36 -0.03648 -0.04090 55 12 1 5 0 900.860 26.94 19.99 24.40 30.99 31.6 1100.00 900000 7955 -69854 139355 -40010 -86879 900000 -70816 900000 -81930 -56154 149080 -75602 -7917 -37620 900000 -28248 44952 -16523 15665 11244 -14615 -12884 -8046 -27772 3773 -21355 -12207 -12816 -21943 39555 -1550 14174 -6075 -7715 4637 10304 42192 4000 -4717 -3542 4667 -3197 4702 4569 5519 -9259 -2916 6284 556 881 2701 -582 1404 1527 1036 5363 -2505 298 -3595 3196 -1525 482 -50 861 -227 -419 -841 1669 1252 999 2137 314 957 1088 3503 -4712 820 -503 649 -169 -1269 -1924 -564 -915 -1374 355 -271 418 301 932 1392 532 -543 -682 632 -362 836 123 -246 148 -1161 -857 -145 188 -930 -1501 -710 -19 1121 -228 80 492 128 172 -66 204 -164 -394 -349 -276 230 179 197 -3 1084 -240 1181 136 179 -36 35 -555 753 -55 -213 -46 202 85 -204 98 -397 -232 900000 40 -780 390 -306 -1031 900000 -919 900000 -1473 -834 418 -1815 -126 -957 900000 -857 760 -531 396 306 -511 -468 -307 -1382 150 -1090 -556 -573 -1123 1321 -88 791 -436 -545 291 676 2441 400 -607 -506 663 -512 716 705 859 -1677 -509 1043 103 178 595 -144 367 423 300 1543 -778 89 -1091 937 -505 175 -20 358 -93 -168 -344 725 617 541 1199 179 521 552 1588 -2142 353 -237 346 -104 -878 -1446 -441 -759 -1211 322 -254 392 275 803 1128 416 -431 -584 596 -384 971 153 -311 179 -1317 -909 -152 209 -1094 -1845 -908 -26 1618 -355 130 798 203 262 -97 297 -246 -620 -570 -453 370 281 302 -5 1558 -338 1667 207 295 -63 64 -1058 1474 -114 -457 -101 445 189 -446 206 -809 -461 SS 20240420T125814.0Z 8876.540440 193 1 49.35 2 76.01 84.24 124.81 299.88 0.00 1 0.00 1 0 17 3.641e-01 2.434e-02 1.107e-01 2.007e-03 5.085786e-01 1.043530e-03 5.759323e-03 -6.000000e+00 2.112078e-01 229.74 -2.00 3.24 -2.00 319.95 0.00e+00 9.098726e-03 3.410104e-04 1.896453e-03 -6.000000e+00 9.430166e-03 288.38 -2.00 20.00 -2.00 319.21 0.00e+00 4.042 0.001 302.00 328.00 3 2.9810e+00 3.0857e-03 4.7412e-02 -6.0000e+00 5.2653e-01 9.7032e-02 3.7055e-03 2.4853e-02 -6.0000e+00 5.6998e-01 -2.0214e-01 2.9065e-03 1.5467e-02 -6.0000e+00 3.4020e-01 9.7607e-02 1.4970e-03 8.6161e-03 -6.0000e+00 1.4504e-01 2.6305e-04 -7.1166e-04 5.6743e-05 1.0181e-04 -6.0000e+00 9.9017e-03 -3.6182e-02 1.4907e-04 12 8 8 10 0 0 95.57 24.40 0.39 -0.03618 -0.04153 63 13 1 5 0 783.310 26.94 20.00 24.40 31.36 31.6 1100.00 -210193 65902 39603 72813 23906 -2783 250455 4905 191587 616 -27761 80314 -15815 27607 19442 900000 27112 44931 29708 30501 37394 26900 28945 21592 14236 12282 11836 8795 16775 8693 37087 21627 23388 17708 12149 20271 18558 31557 11079 6203 4989 9301 5738 10572 11200 12229 5910 6226 12394 8073 10385 7098 6771 5572 6342 2517 2832 -2738 556 -30 2221 2398 3343 3617 3182 2289 1371 1229 1540 780 411 165 -1023 -1243 -18 -595 -4062 -2505 -850 -1036 -1279 -2118 -2875 -2339 -2686 -2909 -1603 -1333 -850 -372 -288 -424 -1309 -1835 -1853 -805 -1021 131 -129 -270 -108 -813 -986 -680 -632 -827 -850 -733 20 227 621 383 649 350 21 297 234 129 483 562 451 1088 958 1180 1044 1537 673 1387 1007 1123 989 327 97 412 -124 -260 -423 -219 -526 -798 -413 -925 -965 -23612 649 529 681 321 -46 490 83 587 12 -720 829 -494 720 670 900000 1114 1693 1371 1457 1699 1326 1416 1171 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