File name: Pandora75s1_EssexMD_20240701_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250116T072955.5Z 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 v1.8.70 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20240701_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: 20240701 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 20240701T135836.9Z 8948.582372 7 1 51.62 2 43.45 97.40 23.00 209.43 0.00 1 0.00 1 0 17 1.025e-02 7.758e-03 1.287e-04 8.377e-05 2.060424e-01 4.523730e-05 2.425784e-03 -6.000000e+00 6.250682e-03 232.82 -2.00 3.48 -2.00 315.21 0.00e+00 6.374094e-04 4.100626e-06 8.452627e-05 -6.000000e+00 2.795831e-04 289.22 -2.00 20.00 -2.00 314.48 0.00e+00 1.376 0.000 302.00 328.00 3 -8.5943e-02 1.1716e-04 1.7480e-02 -6.0000e+00 1.5667e-02 7.7926e-03 1.2985e-04 1.0571e-02 -6.0000e+00 1.6916e-02 6.5555e-04 7.4033e-05 5.0906e-03 -6.0000e+00 1.0085e-02 -6.2497e-03 3.1917e-05 1.3931e-03 -6.0000e+00 4.1807e-03 1.1498e-01 -1.3160e-04 2.6332e-06 2.0166e-05 -6.0000e+00 3.1782e-04 1.8386e-03 -1.1264e-05 11 8 0 10 0 0 12.81 23.46 0.46 0.00184 0.00085 4533 738 1 5 0 11.380 26.21 20.00 23.46 30.17 4.4 1030.30 549 273 -843 -2119 -2905 -2161 -1325 -192 -130 -1627 -2489 -2106 -1075 -268 528 279 356 908 1432 1503 1415 1262 1628 1479 1311 1108 165 -566 -292 143 480 1108 539 -1394 -3020 -3010 -2516 -1416 -219 -439 -697 -370 -235 -96 47 190 -156 -388 -455 40 478 865 1061 1049 816 919 793 338 262 596 1129 1638 1940 1459 557 -237 -608 -282 539 1086 629 657 601 391 -28 -792 -1392 -1699 -1683 -1534 -1749 -1918 -2022 -1761 -866 -502 175 555 462 431 391 -16 -422 -190 -102 83 464 587 148 -263 -883 -1291 -821 -432 -827 -930 -537 -309 386 789 817 596 416 112 -70 -39 136 414 470 385 387 537 575 625 662 290 221 349 329 121 -165 -404 -257 33 78 104 354 251 57 -7 -448 -875 -1025 155 84 -270 -656 -825 -622 -388 -56 -41 -555 -862 -738 -374 -103 211 122 163 427 648 698 670 599 780 737 682 595 89 -293 -142 71 230 557 288 -777 -1650 -1617 -1352 -862 -139 -306 -534 -283 -185 -76 37 149 -120 -291 -349 30 375 680 876 865 695 796 696 298 228 517 1002 1470 1783 1410 538 -226 -540 -253 481 1019 620 677 622 392 -28 -742 -1247 -1448 -1474 -1410 -1714 -1981 -2147 -1967 -986 -587 214 673 561 523 458 -18 -452 -196 -109 92 548 729 187 -328 -1088 -1548 -943 -509 -1008 -1160 -699 -405 527 1093 1138 834 578 150 -89 -50 169 517 627 526 525 748 781 841 845 366 269 425 421 158 -218 -550 -357 47 115 154 524 380 87 -11 -669 -1276 -1479 SS 20240701T140844.9Z 8948.589408 10 1 27.77 2 41.51 99.31 23.99 214.77 0.00 1 0.00 1 0 17 1.013e-02 7.721e-03 1.664e-04 1.106e-04 1.993380e-01 5.986556e-05 2.345992e-03 -6.000000e+00 6.178834e-03 232.82 -2.00 3.48 -2.00 315.11 0.00e+00 6.376384e-04 5.346122e-06 8.091080e-05 -6.000000e+00 2.763682e-04 289.22 -2.00 20.00 -2.00 314.40 0.00e+00 1.334 0.000 302.00 328.00 3 -9.2441e-02 1.5502e-04 1.6931e-02 -6.0000e+00 1.5487e-02 9.5764e-03 1.7169e-04 1.0222e-02 -6.0000e+00 1.6721e-02 8.4828e-05 9.7824e-05 4.9201e-03 -6.0000e+00 9.9689e-03 -6.2583e-03 4.2027e-05 1.3459e-03 -6.0000e+00 4.1327e-03 1.2210e-01 -1.4852e-04 3.4827e-06 1.9624e-05 -6.0000e+00 3.1416e-04 1.7385e-03 -1.1140e-05 11 8 0 10 0 0 17.63 23.50 0.47 0.00174 0.00062 2512 409 1 5 0 11.040 26.21 20.01 23.50 30.30 4.3 1030.24 535 192 -833 -2168 -2886 -2193 -1211 -130 -120 -1588 -2471 -1994 -1006 -282 511 255 313 852 1476 1463 1396 1238 1563 1388 1269 1073 121 -581 -284 146 513 1170 515 -1380 -2987 -2998 -2461 -1402 -206 -433 -665 -371 -236 -150 3 131 -167 -411 -429 51 507 903 1078 1055 813 882 752 325 238 573 1110 1616 1893 1460 554 -230 -602 -276 502 1066 620 642 597 398 -18 -774 -1388 -1698 -1707 -1537 -1769 -1921 -2003 -1713 -856 -493 182 541 455 424 345 -29 -407 -199 -127 66 460 573 184 -247 -843 -1278 -821 -430 -825 -933 -539 -300 370 774 820 606 422 112 -65 -22 148 415 463 382 387 536 557 627 661 309 222 359 341 135 -157 -396 -251 7 44 71 335 245 58 -26 -446 -866 -1020 162 63 -285 -716 -872 -620 -347 -40 -41 -533 -841 -685 -368 -114 215 117 141 393 697 710 690 613 781 721 687 563 64 -312 -143 71 253 607 284 -745 -1678 -1655 -1359 -828 -134 -309 -498 -291 -190 -122 2 105 -131 -314 -336 40 385 721 863 883 702 774 669 290 210 503 998 1470 1760 1427 541 -211 -538 -250 450 1005 614 666 621 402 -17 -730 -1250 -1453 -1500 -1415 -1736 -1985 -2127 -1913 -974 -576 223 656 553 514 404 -32 -435 -204 -135 74 541 708 231 -306 -1033 -1523 -938 -503 -1000 -1158 -698 -392 502 1065 1133 840 581 148 -83 -27 183 532 611 518 538 740 751 837 836 386 276 449 430 174 -212 -531 -343 9 63 104 503 365 87 -39 -658 -1246 -1454 SS 20240701T140912.8Z 8948.589731 10 2 27.74 2 41.43 99.40 24.04 215.01 0.00 1 0.00 1 0 17 1.017e-02 7.759e-03 1.662e-04 1.105e-04 1.991483e-01 5.980129e-05 2.343668e-03 -6.000000e+00 6.198071e-03 232.82 -2.00 3.48 -2.00 315.11 0.00e+00 6.118249e-04 5.338575e-06 8.258211e-05 -6.000000e+00 2.772282e-04 289.22 -2.00 20.00 -2.00 314.40 0.00e+00 1.332 0.000 302.00 328.00 3 -9.2525e-02 1.5488e-04 1.6909e-02 -6.0000e+00 1.5535e-02 8.6677e-03 1.7158e-04 1.0207e-02 -6.0000e+00 1.6773e-02 4.3341e-04 9.7741e-05 4.9150e-03 -6.0000e+00 9.9999e-03 -6.2160e-03 4.1979e-05 1.3421e-03 -6.0000e+00 4.1456e-03 1.2241e-01 -1.2291e-04 3.4781e-06 1.9532e-05 -6.0000e+00 3.1514e-04 1.7560e-03 -9.2698e-06 11 8 0 10 0 0 25.08 23.50 0.47 0.00176 0.00083 2512 409 1 5 0 11.040 26.21 20.01 23.50 30.30 4.3 1030.24 631 188 -851 -2079 -2932 -2118 -1187 -184 -87 -1542 -2454 -2054 -1018 -319 474 294 328 864 1451 1442 1388 1186 1625 1424 1262 1050 129 -601 -290 159 531 1132 493 -1440 -3023 -3027 -2484 -1407 -233 -465 -693 -387 -243 -119 -8 151 -179 -436 -480 20 477 828 1038 1032 830 886 766 351 253 553 1118 1631 1915 1448 570 -257 -592 -274 535 1105 631 682 601 407 -7 -791 -1365 -1677 -1687 -1531 -1749 -1922 -2010 -1758 -877 -495 185 553 486 460 388 -15 -409 -176 -124 76 441 579 160 -278 -877 -1311 -821 -441 -834 -921 -537 -299 391 807 828 603 429 106 -71 -37 144 401 476 368 378 519 574 618 651 293 220 348 324 137 -163 -389 -250 27 84 90 355 257 54 -16 -465 -888 -1019 191 62 -291 -687 -888 -599 -341 -57 -29 -518 -837 -707 -374 -130 200 135 148 399 686 701 687 588 813 741 685 553 68 -324 -146 77 263 588 272 -779 -1601 -1674 -1374 -832 -152 -333 -520 -304 -196 -97 -6 121 -141 -334 -358 15 363 663 832 865 718 779 683 313 224 486 964 1485 1784 1417 558 -237 -530 -248 480 1043 625 707 627 411 -7 -746 -1231 -1437 -1484 -1412 -1719 -1989 -2137 -1967 -999 -579 226 671 591 558 454 -17 -438 -182 -132 85 520 716 200 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