File name: Pandora75s1_EssexMD_20250209_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250210T052401.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20250209_L1_smca1c3d20230525p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20250209 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 session based on session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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 20250209T140421.9Z 9171.586365 279 1 51.61 2 70.50 129.24 113.06 348.04 0.00 1 0.00 1 0 17 2.865e-02 7.696e-03 1.609e-03 3.608e-04 3.598006e-01 1.860940e-04 4.191753e-03 -6.000000e+00 1.694007e-02 224.78 -2.00 3.48 -2.00 317.86 0.00e+00 1.489968e-03 3.136267e-05 3.966678e-04 -6.000000e+00 7.413607e-04 276.55 -2.00 20.00 -2.00 317.22 0.00e+00 2.962 0.000 302.00 328.00 3 1.0793e+00 4.9367e-04 3.4428e-02 -6.0000e+00 4.1829e-02 1.4193e-02 5.5796e-04 1.7925e-02 -6.0000e+00 4.5548e-02 -1.6881e-02 3.5088e-04 8.9502e-03 -6.0000e+00 2.7122e-02 8.1197e-04 1.7620e-04 2.7855e-03 -6.0000e+00 1.1270e-02 6.2123e-03 9.5428e-05 1.1320e-05 3.3437e-05 -6.0000e+00 8.8602e-04 9.6748e-03 1.3322e-05 11 8 0 10 0 0 99.80 23.05 0.45 0.00967 0.01039 565 92 1 5 0 91.340 25.90 19.99 23.05 11.19 5.8 908.42 -9093 -6008 -5658 -7636 -10947 -11246 -9629 -9329 -7828 -8453 -9659 -8383 -5991 -3454 -1195 -524 -8 1053 1353 1343 1347 1423 1135 621 168 46 -1284 -2087 -1966 -1097 -346 529 469 -1766 -3415 -3455 -2593 -1307 -53 18 -428 50 123 424 632 879 500 204 101 600 894 1289 1561 1481 1207 1176 821 129 161 543 1334 2082 2379 1827 845 81 -440 -137 703 1160 773 818 608 212 -203 -1139 -1735 -1954 -1991 -1751 -1706 -1937 -2063 -1771 -857 -435 303 683 561 512 368 -178 -677 -501 -431 -40 466 521 51 -365 -983 -1368 -846 -458 -844 -946 -476 -216 518 858 747 461 284 -82 -190 -75 153 460 542 455 527 639 703 694 592 108 156 208 183 -15 -311 -468 -258 -15 75 161 463 317 156 58 -455 -815 -876 -603 -434 -427 -570 -782 -776 -682 -728 -667 -773 -923 -841 -670 -444 -176 -79 -1 180 243 251 257 274 225 131 38 11 -305 -482 -437 -244 -83 138 134 -492 -945 -954 -769 -444 -19 8 -205 23 60 211 315 439 250 102 51 308 486 753 909 916 780 781 557 88 108 364 918 1436 1786 1386 654 61 -335 -104 532 975 672 742 552 185 -175 -899 -1351 -1492 -1522 -1506 -1565 -1872 -2151 -1856 -952 -488 354 820 672 591 416 -187 -707 -520 -454 -45 552 651 68 -479 -1224 -1659 -1021 -564 -1062 -1207 -637 -291 741 1261 1116 704 439 -119 -271 -102 208 651 781 689 806 961 1027 1013 826 151 212 291 263 -23 -475 -743 -423 -25 126 282 833 560 276 103 -782 -1407 -1499 SS 20250209T140936.3Z 9171.590003 282 1 51.55 2 69.72 130.31 113.26 349.23 0.00 1 0.00 1 0 17 2.633e-02 7.509e-03 2.236e-03 5.041e-04 3.472140e-01 2.599845e-04 4.048918e-03 -6.000000e+00 1.556677e-02 224.78 -2.00 3.48 -2.00 317.85 0.00e+00 1.497117e-03 4.376887e-05 3.986399e-04 -6.000000e+00 6.812490e-04 276.55 -2.00 20.00 -2.00 317.21 0.00e+00 2.855 0.000 302.00 328.00 3 1.8264e+00 6.8967e-04 3.3206e-02 -6.0000e+00 3.8438e-02 1.6971e-02 7.7919e-04 1.7317e-02 -6.0000e+00 4.1856e-02 -1.4327e-02 4.8994e-04 8.6461e-03 -6.0000e+00 2.4923e-02 -7.1005e-04 2.4616e-04 2.6999e-03 -6.0000e+00 1.0356e-02 3.3083e-03 1.1155e-04 1.5883e-05 3.2015e-05 -6.0000e+00 8.1418e-04 9.6143e-03 1.4972e-05 11 8 0 10 0 0 99.92 23.05 0.48 0.00961 0.01045 374 61 1 5 0 137.830 25.90 20.00 23.05 11.42 5.9 911.09 -9416 -6570 -3416 -8259 -9093 -10275 -8951 -6510 -7518 -7570 -8869 -7809 -5006 -3708 -562 -536 12 772 938 978 2006 1482 1323 617 -137 -34 -1201 -1743 -1798 -517 -567 543 630 -1917 -3421 -3112 -2355 -1295 -23 -205 -484 -98 299 304 505 836 542 215 49 516 835 1265 1425 1470 1044 1070 622 106 53 477 1263 1949 2354 1730 887 11 -411 -95 724 1339 849 823 631 326 -174 -1004 -1649 -2009 -2055 -1814 -1817 -1924 -1953 -1705 -868 -382 270 697 549 503 297 -249 -608 -480 -370 -26 462 550 82 -438 -953 -1355 -797 -439 -883 -1024 -481 -262 519 837 716 458 291 -74 -229 -38 124 442 464 485 541 687 626 649 586 81 186 189 212 22 -318 -401 -224 -83 93 87 363 361 96 97 -407 -786 -853 -642 -488 -257 -632 -649 -713 -639 -501 -646 -693 -848 -783 -555 -477 -82 -88 2 130 166 180 375 280 257 127 -30 -8 -278 -391 -388 -111 -131 137 173 -560 -991 -895 -728 -421 -9 -91 -221 -47 149 155 258 428 277 109 25 269 460 694 835 911 677 712 423 72 36 320 869 1339 1756 1384 677 9 -308 -71 572 1099 762 727 557 294 -147 -825 -1258 -1501 -1631 -1515 -1612 -1894 -1956 -1806 -923 -431 318 841 662 584 322 -264 -607 -476 -391 -29 542 711 107 -566 -1227 -1624 -955 -538 -1101 -1354 -634 -364 727 1253 1084 705 436 -110 -317 -52 171 636 677 742 801 1047 929 923 834 110 247 257 310 33 -485 -636 -366 -135 160 152 647 653 174 170 -692 -1350 -1451 SS 20250209T141429.2Z 9171.593393 285 1 51.71 2 69.00 131.31 113.43 350.34 0.00 1 0.00 1 0 17 2.162e-02 7.590e-03 1.121e-03 3.021e-04 3.376010e-01 1.560205e-04 3.941721e-03 -6.000000e+00 1.278381e-02 224.78 -2.00 3.48 -2.00 317.55 0.00e+00 1.347751e-03 2.400586e-05 3.192629e-04 -6.000000e+00 5.594429e-04 276.55 -2.00 20.00 -2.00 316.91 0.00e+00 2.764 0.000 302.00 328.00 3 9.4959e-01 4.1100e-04 3.2158e-02 -6.0000e+00 3.1566e-02 1.2611e-02 4.6407e-04 1.6777e-02 -6.0000e+00 3.4373e-02 -1.3781e-02 2.8348e-04 8.3390e-03 -6.0000e+00 2.0467e-02 -2.9496e-04 1.3955e-04 2.5576e-03 -6.0000e+00 8.5049e-03 8.8122e-03 1.0332e-04 9.4723e-06 3.0356e-05 -6.0000e+00 6.6861e-04 9.6060e-03 2.1071e-05 11 8 0 10 0 0 99.79 23.06 0.47 0.00961 0.01038 759 124 1 5 0 67.940 25.90 20.00 23.06 11.79 5.9 913.26 -5619 -4141 -4092 -5957 -7257 -8586 -6814 -5810 -5835 -6129 -7850 -6545 -4304 -2444 -830 -273 292 890 1477 1539 1563 1447 1396 1162 723 134 -1083 -1638 -1530 -646 -124 661 345 -1700 -3140 -3222 -2722 -1296 29 -134 -341 0 167 205 544 773 416 -40 45 401 923 1211 1455 1470 1048 1103 781 187 105 572 1209 1953 2319 1729 819 -60 -507 -122 621 1186 788 746 563 248 -150 -1072 -1611 -1926 -1972 -1696 -1808 -2012 -2030 -1701 -886 -384 287 668 540 535 325 -176 -630 -412 -366 16 473 469 120 -363 -987 -1343 -836 -485 -865 -927 -495 -216 509 794 761 515 247 -67 -168 -21 192 456 496 421 512 676 704 655 580 123 114 240 169 -18 -283 -472 -210 11 74 170 411 309 128 40 -412 -814 -903 -460 -374 -385 -553 -630 -725 -589 -549 -609 -683 -916 -797 -581 -379 -134 -49 57 181 315 340 353 330 327 287 189 37 -301 -441 -395 -166 -34 181 103 -538 -983 -1005 -914 -497 12 -60 -170 0 91 114 303 432 231 -22 25 226 513 722 924 926 690 745 538 130 72 389 845 1457 1767 1411 680 -48 -386 -92 497 994 722 676 511 229 -129 -893 -1244 -1454 -1578 -1437 -1637 -2022 -2086 -1847 -972 -446 332 793 641 611 363 -192 -645 -418 -395 18 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