File name: Pandora75s1_EssexMD_20260220_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20260221T052520.5Z 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 v1.8.88 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20260220_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: 20260220 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 20260220T175915.3Z 9547.749482 255 1 3.96 2 50.88 192.60 40.16 135.72 0.00 1 0.00 1 0 17 1.309e-02 8.840e-03 7.095e-03 3.954e-03 2.264118e-01 2.067023e-03 2.694995e-03 -6.000000e+00 7.747703e-03 225.25 -2.00 3.48 -2.00 315.77 0.00e+00 9.277439e-04 2.074436e-04 8.984870e-05 -6.000000e+00 3.390421e-04 276.90 -2.00 20.00 -2.00 315.19 0.00e+00 1.581 0.000 302.00 328.00 3 4.3966e+00 5.3082e-03 1.9381e-02 -6.0000e+00 1.9149e-02 3.4751e-02 5.9353e-03 1.1270e-02 -6.0000e+00 2.0846e-02 1.6561e-03 3.4084e-03 5.5579e-03 -6.0000e+00 1.2410e-02 -7.4310e-03 1.5152e-03 1.6399e-03 -6.0000e+00 5.1521e-03 1.0241e-03 -2.0156e-04 1.2452e-04 2.2092e-05 -6.0000e+00 4.0469e-04 1.0789e-02 -1.8577e-05 12 9 1 12 1 1 999.00 23.23 0.49 0.01079 0.00927 2 6 1 5 0 1317.600 26.00 20.00 23.23 19.16 7.8 971.00 -930 -2020 1528 -3750 -1051 -4914 -2472 -1854 -532 -417 -3203 -1247 -3388 778 1257 -339 485 335 828 2215 1799 2266 2637 1339 2046 605 772 -1855 -1361 454 112 645 1153 -677 -4048 -1800 -2889 -1660 -906 -535 -1202 1165 29 -619 -863 -37 -461 -715 -251 281 1224 1151 551 1235 1011 1794 528 568 -542 1234 568 2096 2489 1441 965 -1276 -100 -140 1246 1012 569 428 380 685 41 -1340 -1169 -2596 -1988 -1508 -1534 -1647 -1837 -1210 -955 -115 -340 518 709 539 94 -337 -312 -466 -912 -10 992 459 -123 -250 -1175 -1098 -875 -54 -781 -1064 -395 -161 255 620 874 749 483 280 -157 -573 267 -213 512 102 834 422 770 1182 -82 550 384 785 342 151 196 -663 -470 -303 78 -43 520 307 379 220 -170 -1188 -1379 -210 -503 376 -925 -230 -1059 -536 -436 -135 -111 -886 -347 -964 240 434 -130 179 128 327 886 735 922 1085 580 918 283 359 -844 -580 186 48 291 550 -335 -1999 -859 -1496 -906 -540 -366 -849 844 22 -475 -662 -28 -344 -520 -178 199 892 889 425 989 836 1498 451 483 -461 1030 493 1802 2287 1328 935 -1182 -85 -124 1082 974 566 445 395 684 41 -1216 -1022 -2201 -1737 -1369 -1467 -1728 -1958 -1352 -1081 -137 -409 636 867 665 108 -374 -336 -489 -955 -12 1173 568 -160 -320 -1432 -1307 -1000 -63 -982 -1355 -524 -214 353 865 1264 1086 673 380 -206 -718 332 -277 673 142 1180 595 1053 1610 -108 713 481 989 435 204 265 -926 -670 -430 116 -64 796 480 592 336 -262 -1800 -2073 SS 20260220T181317.5Z 9547.759231 261 1 51.66 2 51.57 196.94 38.32 140.26 0.00 1 0.00 1 0 17 1.560e-02 7.968e-03 3.995e-03 1.712e-03 2.301017e-01 8.840687e-04 2.731571e-03 -6.000000e+00 9.238916e-03 225.25 -2.00 3.48 -2.00 316.63 0.00e+00 7.469772e-04 1.087145e-04 1.545721e-04 -6.000000e+00 4.042632e-04 276.90 -2.00 20.00 -2.00 316.02 0.00e+00 1.605 0.000 302.00 328.00 3 5.3942e+00 2.2949e-03 1.9695e-02 -6.0000e+00 2.2835e-02 2.5910e-02 2.5803e-03 1.1457e-02 -6.0000e+00 2.4857e-02 1.4642e-04 1.4976e-03 5.6728e-03 -6.0000e+00 1.4799e-02 -6.3364e-03 6.9189e-04 1.6452e-03 -6.0000e+00 6.1440e-03 3.6852e-04 -6.2097e-07 5.4305e-05 2.1149e-05 -6.0000e+00 4.8253e-04 1.0996e-02 1.0761e-05 11 8 0 10 0 0 99.99 23.27 0.48 0.01100 0.01099 61 10 2 5 0 846.840 26.11 20.00 23.27 19.18 7.7 970.05 -11664 -174 1617 -2929 -4707 -3352 523 -1373 -1177 -2980 -2153 -2186 -102 456 -206 -171 -336 470 -369 1165 2186 1631 2242 1676 -333 716 -729 -1871 494 1455 890 -592 2461 -2409 -2664 -2466 -1698 -2375 -127 67 -891 35 -318 395 -432 704 203 -270 -184 510 651 490 1838 1463 1261 1250 260 25 -49 160 1218 1418 1991 1502 400 -132 -671 -326 842 1344 298 1106 621 -225 -344 -870 -856 -1253 -1762 -1942 -1908 -2355 -1845 -1863 -775 -275 -61 687 337 531 330 -144 -495 -552 63 265 1063 276 280 -338 -735 -1409 -794 -527 -838 -1033 -607 -64 306 881 1203 573 238 -181 -195 117 -188 27 560 214 590 401 864 491 576 -55 210 529 473 -5 -120 -384 -260 31 114 -23 396 262 14 170 -344 -805 -967 -2037 -30 276 -498 -743 -495 77 -224 -210 -571 -413 -430 -22 108 -55 -50 -104 149 -111 356 739 555 771 549 -116 254 -262 -646 173 493 314 -226 881 -924 -988 -993 -663 -1074 -66 40 -542 22 -208 259 -285 456 130 -169 -112 311 413 330 1288 1078 959 969 205 20 -38 124 969 1200 1661 1319 352 -118 -566 -268 722 1170 285 1093 617 -217 -310 -772 -693 -974 -1430 -1746 -1761 -2393 -1991 -2123 -866 -326 -76 871 428 648 373 -161 -515 -559 66 305 1247 356 377 -451 -927 -1670 -901 -614 -1048 -1369 -840 -86 431 1301 1841 885 353 -251 -268 152 -245 37 752 305 854 577 1204 704 783 -72 263 668 630 -7 -166 -547 -379 47 182 -36 634 428 22 271 -569 -1299 -1549 SS 20260220T204301.8Z 9547.863215 358 1 14.39 2 68.75 234.87 33.43 204.15 0.00 1 0.00 1 0 17 3.883e-02 8.047e-03 8.484e-03 1.636e-03 3.816510e-01 8.452355e-04 4.447628e-03 -6.000000e+00 2.299955e-02 225.26 -2.00 3.48 -2.00 318.03 0.00e+00 1.538722e-03 1.512796e-04 4.544554e-04 -6.000000e+00 1.006148e-03 276.91 -2.00 20.00 -2.00 317.41 0.00e+00 2.733 0.000 302.00 328.00 3 2.9177e+00 2.2497e-03 3.3249e-02 -6.0000e+00 5.6846e-02 2.7670e-02 2.5473e-03 1.9058e-02 -6.0000e+00 6.1875e-02 -1.1266e-02 1.6413e-03 9.5344e-03 -6.0000e+00 3.6838e-02 -1.0581e-04 8.3640e-04 2.9583e-03 -6.0000e+00 1.5298e-02 1.1638e-03 -2.9486e-05 5.0891e-05 3.4730e-05 -6.0000e+00 1.2009e-03 9.5414e-03 2.1541e-05 12 9 1 12 1 1 98.12 23.48 0.49 0.00954 0.00932 24 15 1 5 0 575.500 26.21 20.00 23.48 18.56 7.7 965.75 -23462 -4083 1452 -12464 -10419 -12147 -12859 -14655 -12607 -10912 -8346 -10630 -5529 -3885 -3391 -895 299 312 -291 138 3498 1379 1316 969 1433 -1297 -873 -3152 -1768 -32 740 239 501 -2252 -4185 -3593 -3331 -1357 -80 158 -430 134 245 685 4 1379 609 -468 51 878 845 1267 1684 2223 1434 1524 715 377 54 329 1419 1697 2252 1671 1125 107 173 -288 636 949 771 1173 686 267 -554 -1290 -1643 -2059 -2182 -2085 -1516 -2105 -2075 -1785 -987 -387 336 608 579 669 314 -139 -665 -717 -530 -127 479 651 407 -149 -926 -1514 -787 -586 -879 -933 -746 -136 612 981 874 675 141 -60 -326 52 13 341 496 402 359 666 711 669 497 196 61 319 243 68 -138 -442 -237 -156 -13 137 371 331 -83 111 -602 -565 -742 -1464 -237 84 -806 -612 -700 -780 -1001 -936 -852 -658 -916 -520 -426 -435 -127 46 46 -46 23 568 231 227 177 276 -268 -181 -645 -345 -6 155 56 128 -617 -1143 -973 -975 -414 -29 66 -186 61 116 330 2 669 297 -230 25 442 453 679 964 1345 913 997 448 236 36 218 896 1151 1661 1244 854 79 130 -218 477 792 661 1046 613 229 -472 -1004 -1265 -1559 -1653 -1783 -1373 -2011 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