File name: Pandora75s1_EssexMD_20250426_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250427T051110.8Z 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 v1.8.75 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20250426_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: 20250426 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 20250426T140959.1Z 9247.590268 193 1 52.23 2 45.88 111.54 38.57 135.02 0.00 1 0.00 1 0 17 1.423e-02 8.801e-03 3.250e-03 1.702e-03 2.171003e-01 9.011069e-04 2.540551e-03 -6.000000e+00 8.574074e-03 229.66 -2.00 3.48 -2.00 316.01 0.00e+00 1.130005e-03 9.550554e-05 1.191824e-04 -6.000000e+00 3.774367e-04 282.58 -2.00 20.00 -2.00 315.32 0.00e+00 1.434 0.000 302.00 328.00 3 5.6657e+00 2.3403e-03 1.8150e-02 -6.0000e+00 2.1372e-02 3.6613e-02 2.6099e-03 1.0973e-02 -6.0000e+00 2.3159e-02 -5.4477e-03 1.4937e-03 5.3221e-03 -6.0000e+00 1.3787e-02 -4.9176e-03 6.6833e-04 1.5794e-03 -6.0000e+00 5.7113e-03 3.3430e-04 1.2802e-04 5.3771e-05 1.9792e-05 -6.0000e+00 4.4062e-04 4.8273e-03 6.0447e-05 11 9 0 11 40 0 99.94 23.85 0.55 0.00483 0.00579 16 3 1 5 0 3263.940 26.51 20.00 23.85 30.20 6.1 1042.13 -3318 -143 4291 929 -4685 -4553 1678 -3726 -727 -2183 -3348 -3856 -2213 1496 1504 -1619 -775 804 487 623 1341 2037 1395 2392 647 1771 -177 -621 -1367 2337 -12 328 505 -1573 -2476 -2757 -3137 -1446 192 145 -905 663 54 237 -511 256 -119 -837 -1288 309 293 234 1422 1980 1532 1611 458 -430 -372 -106 527 2586 2129 1394 770 -395 -752 -607 598 1410 198 1433 266 418 -222 -725 -1498 -1952 -2081 -2484 -1887 -2089 -1797 -1486 -1009 -187 109 812 543 1084 259 -228 -804 -1224 -367 335 599 446 760 18 -815 -1327 -490 -806 -1129 -931 -444 143 663 895 1237 695 192 -245 -269 592 -18 -86 578 425 512 512 606 578 603 -278 89 201 242 -21 -752 -387 -245 -215 -90 290 124 409 103 217 -354 -719 -761 -710 -32 952 204 -988 -904 320 -817 -169 -542 -846 -999 -612 408 461 -560 -279 295 185 243 528 796 555 977 280 779 -79 -265 -553 888 -5 139 227 -737 -1129 -1240 -1514 -720 111 97 -616 466 40 174 -378 187 -85 -588 -886 209 206 174 1099 1591 1274 1264 367 -347 -296 -84 429 2190 1943 1343 740 -360 -639 -502 512 1322 191 1424 268 406 -217 -646 -1318 -1641 -1806 -2214 -1859 -2108 -1930 -1678 -1134 -222 136 1036 695 1328 297 -256 -837 -1238 -383 379 700 569 952 23 -1026 -1567 -589 -937 -1407 -1225 -574 192 928 1244 1781 1008 269 -340 -365 754 -23 -114 767 597 737 733 844 771 810 -359 110 250 316 -29 -1030 -543 -351 -320 -132 446 197 659 166 343 -545 -1079 -1131 SS 20250426T141843.8Z 9247.596340 199 1 50.82 2 44.32 113.57 37.39 137.87 0.00 1 0.00 1 0 17 1.443e-02 9.105e-03 3.207e-03 1.737e-03 2.093948e-01 9.175436e-04 2.440959e-03 -6.000000e+00 8.698152e-03 229.66 -2.00 3.48 -2.00 315.89 0.00e+00 8.940942e-04 9.496537e-05 1.140004e-04 -6.000000e+00 3.828520e-04 282.58 -2.00 20.00 -2.00 315.21 0.00e+00 1.396 0.000 302.00 328.00 3 5.7280e+00 2.3808e-03 1.7584e-02 -6.0000e+00 2.1681e-02 3.1406e-02 2.6548e-03 1.0538e-02 -6.0000e+00 2.3492e-02 -1.6709e-03 1.5181e-03 5.1140e-03 -6.0000e+00 1.3986e-02 -4.8636e-03 6.7360e-04 1.4728e-03 -6.0000e+00 5.7950e-03 3.3153e-04 4.0810e-04 5.4965e-05 1.9508e-05 -6.0000e+00 4.4688e-04 4.1286e-03 9.8733e-05 11 9 0 11 32 0 99.94 23.85 0.38 0.00413 0.00720 16 3 1 5 0 3176.090 26.51 20.00 23.85 30.41 6.0 1043.33 -2275 1683 3694 931 -5998 -5424 767 -375 -2378 -2636 -5010 -2068 -746 1726 1125 -515 -13 -171 573 912 1170 2865 999 1367 625 1403 185 -2044 -470 409 -570 890 1107 -1158 -2225 -3232 -3517 -1932 401 379 -1074 681 691 102 -435 -121 -640 -852 -872 260 266 96 995 1956 1608 1684 654 13 186 -166 1043 2730 2103 1331 630 -640 -564 -541 396 1536 375 1232 -86 484 -198 -1249 -2012 -1497 -2468 -2497 -1676 -2210 -1751 -1798 -616 -101 33 555 604 1275 557 -202 -858 -763 -1133 202 538 635 832 63 -498 -1462 -664 -531 -862 -1008 -598 14 438 1085 1336 699 144 -52 -475 480 -369 -57 351 466 581 631 695 620 536 -171 181 -6 396 2 -447 -548 -482 -337 61 -47 290 633 42 240 -211 -844 -689 -508 394 867 214 -1344 -1139 155 -83 -591 -690 -1352 -551 -212 489 359 -183 -5 -65 224 365 475 1144 412 582 279 638 85 -913 -194 163 -235 384 504 -550 -1029 -1486 -1733 -983 235 256 -744 486 507 76 -326 -90 -467 -605 -604 177 188 72 778 1582 1344 1431 527 10 160 -143 848 2321 1928 1287 608 -585 -478 -447 339 1435 360 1225 -86 469 -194 -1118 -1777 -1250 -2142 -2216 -1638 -2218 -1868 -2023 -685 -119 41 706 768 1550 633 -225 -886 -816 -1181 226 622 799 1093 82 -617 -1708 -789 -650 -1060 -1314 -813 18 607 1575 1895 999 211 -70 -636 602 -465 -75 488 645 823 887 951 864 709 -217 220 -7 507 3 -599 -753 -676 -491 93 -71 450 996 67 371 -318 -1316 -1060 SS 20250426T170815.9Z 9247.714073 308 1 5.87 2 25.57 182.60 33.28 211.88 0.00 1 0.00 1 0 17 9.673e-03 7.902e-03 8.788e-04 6.610e-04 1.683211e-01 3.562549e-04 2.001617e-03 -6.000000e+00 5.829555e-03 229.67 -2.00 3.48 -2.00 314.45 0.00e+00 5.902589e-04 2.768099e-05 4.517644e-05 -6.000000e+00 2.566094e-04 282.59 -2.00 20.00 -2.00 313.90 0.00e+00 1.108 0.000 302.00 328.00 3 2.2170e+00 9.1125e-04 1.4061e-02 -6.0000e+00 1.4531e-02 2.3356e-02 1.0086e-03 8.5271e-03 -6.0000e+00 1.5745e-02 -3.9158e-03 5.7739e-04 4.1380e-03 -6.0000e+00 9.3739e-03 -4.5939e-03 2.4408e-04 1.1613e-03 -6.0000e+00 3.8835e-03 1.6086e-02 2.1716e-04 2.0739e-05 1.7736e-05 -6.0000e+00 2.9953e-04 4.5025e-03 8.2279e-05 12 9 1 12 1 1 99.85 23.86 0.47 0.00450 0.00613 53 77 1 5 0 108.490 26.51 19.99 23.86 31.59 6.1 1051.68 463 405 -659 -1854 -2752 -1854 -802 246 427 -1031 -2127 -1858 -738 -124 527 375 339 644 1159 1261 1499 1294 1482 1546 1311 964 19 -400 -275 499 605 944 403 -1533 -2471 -3015 -2371 -1346 -230 -409 -788 -481 -273 -213 -175 160 -296 -499 -547 53 461 835 1067 1146 732 718 763 251 153 598 1166 1486 1770 1344 669 -108 -587 -162 500 970 679 783 651 482 50 -830 -1270 -1712 -1667 -1650 -1808 -1953 -1987 -1696 -786 -447 166 542 467 435 329 -88 -517 -224 -28 117 582 569 105 -224 -760 -1304 -762 -553 -793 -875 -628 -223 429 817 752 584 320 89 -81 -61 190 411 546 422 392 573 634 647 789 347 214 303 366 244 -270 -415 -264 -12 22 172 281 221 102 23 -482 -964 -1028 174 164 -274 -739 -1072 -671 -293 96 170 -437 -911 -798 -335 -58 271 196 184 357 655 729 829 757 825 888 783 592 11 -234 -159 275 339 551 234 -922 -1441 -1835 -1444 -877 -165 -322 -649 -396 -230 -180 -148 133 -252 -411 -437 42 371 704 899 1005 661 658 677 223 140 545 1043 1404 1708 1357 670 -106 -532 -148 470 960 702 814 680 489 49 -783 -1139 -1521 -1512 -1565 -1821 -2063 -2150 -1857 -877 -530 200 667 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