File name: Pandora75s1_EssexMD_20251015_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20251016T045623.8Z 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_20251015_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: 20251015 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 20251015T120749.7Z 9419.505436 248 1 6.14 2 81.17 109.00 21.28 159.59 0.00 1 0.00 1 0 17 6.083e-01 3.506e-02 3.564e-01 1.733e-02 6.192686e-01 9.614595e-03 9.481367e-03 -6.000000e+00 3.665190e-01 226.21 -2.00 3.48 -2.00 321.11 0.00e+00 7.421783e-03 4.594595e-03 1.107577e-02 -6.000000e+00 1.785558e-02 285.46 -2.00 20.00 -2.00 320.51 0.00e+00 6.156 0.004 302.00 328.00 3 2.3393e+00 3.2893e-02 8.6948e-02 -6.0000e+00 9.0580e-01 4.2041e-01 4.1615e-02 7.4299e-02 -6.0000e+00 9.8568e-01 -7.1133e-01 3.2779e-02 2.8590e-02 -6.0000e+00 5.8840e-01 3.2541e-01 1.5481e-02 4.6032e-03 -6.0000e+00 2.4749e-01 6.1345e-05 5.9889e-04 5.4743e-04 2.4758e-04 -6.0000e+00 1.9082e-02 1.0120e-02 1.4175e-05 12 9 9 12 1 1 999.00 23.55 0.69 0.01012 0.01462 2 4 1 5 0 2045.340 26.32 20.00 23.55 21.87 7.4 974.58 -177409 900000 900000 -42597 3601 -84214 900000 -115207 -117906 4549 -158907 900000 900000 -19567 900000 31570 900000 54276 72897 111182 99569 900000 131903 88717 73993 262013 3977 4092 255330 261627 1309 -1834 75702 56259 -18551 105097 118977 19859 156203 119125 72677 81241 59099 81000 7174 58586 30026 59811 38795 38017 16896 28277 16581 33313 35367 30511 11591 12599 13397 6788 11440 44534 10577 6409 18668 3709 15652 -2461 10534 17549 7631 10704 -66 -8598 -2297 -3981 2917 -329 -7372 -17443 403 -5092 -1402 287 -5939 2410 1257 -5682 365 -2737 52 -2403 -6731 -6113 -1399 -155 -4200 -1831 49 466 -5026 -2742 -1608 -2524 -3377 -663 -660 -966 753 1389 71 1358 -1166 663 -964 1142 431 390 1076 369 2356 735 3434 1200 2240 -848 2893 -22 4258 946 434 -1648 -1168 5 -372 910 -36 460 -741 661 269 -1469 -3016 -15511 900000 900000 -1045 61 -2583 900000 -4948 -5425 77 -11456 900000 900000 -570 900000 775 900000 1249 1599 1876 1680 900000 2226 1647 1623 4421 174 173 4308 4414 68 -114 2427 2278 -1534 2483 2610 1340 3163 4020 4292 4660 4387 4920 920 4547 3141 4743 3927 4105 2452 4008 2854 5171 5609 5199 2405 2551 2622 1409 2355 7213 2695 1871 5008 1139 4225 -822 3377 5892 3077 4335 -29 -3917 -899 -1437 930 -111 -2985 -9153 205 -2820 -817 176 -4136 1642 908 -4514 272 -2028 35 -1570 -4481 -4219 -1030 -130 -4252 -1877 53 498 -5350 -2856 -1559 -2505 -3595 -731 -711 -1129 953 1943 109 2175 -1767 1032 -1456 1644 636 603 1746 575 3875 1194 5264 1814 3224 -1220 3978 -34 6825 1609 808 -3335 -2303 11 -819 2068 -85 1085 -1749 1472 568 -3007 -6186 SS 20251015T131403.6Z 9419.551431 284 1 51.60 2 69.57 120.96 21.73 202.28 0.00 1 0.00 1 0 17 1.969e-02 7.571e-03 7.738e-04 2.199e-04 3.208641e-01 1.143084e-04 3.772710e-03 -6.000000e+00 1.170625e-02 226.20 -2.00 3.48 -2.00 317.48 0.00e+00 1.084519e-03 1.773001e-05 3.647011e-04 -6.000000e+00 5.285845e-04 285.46 -2.00 20.00 -2.00 316.69 0.00e+00 2.835 0.000 302.00 328.00 3 2.5425e-01 3.0193e-04 3.2487e-02 -6.0000e+00 2.8911e-02 -4.0171e-03 3.4097e-04 1.6172e-02 -6.0000e+00 3.1402e-02 -2.9638e-03 2.0519e-04 7.9277e-03 -6.0000e+00 1.8779e-02 -3.7569e-03 1.0039e-04 2.2746e-03 -6.0000e+00 7.8485e-03 1.6970e-02 -9.4301e-05 6.9237e-06 2.7985e-05 -6.0000e+00 6.0941e-04 1.0445e-02 9.4344e-06 11 8 0 10 0 0 23.23 23.57 0.45 0.01045 0.00974 1471 239 1 5 0 35.070 26.32 20.00 23.57 22.89 7.6 982.70 -4448 -3119 -3557 -5678 -7489 -7364 -6223 -5110 -4471 -6104 -6485 -5667 -3743 -2073 -517 -123 169 853 1412 1511 1495 1405 1368 1051 929 598 -488 -1545 -1306 -651 -134 648 155 -1803 -3390 -3491 -2843 -1502 -88 -229 -393 88 176 370 559 626 360 -46 -187 367 774 1090 1315 1357 1052 1091 785 327 142 602 1330 1924 2250 1775 780 20 -386 -102 704 1223 755 743 574 295 -227 -1030 -1600 -1900 -1913 -1676 -1716 -1963 -2029 -1728 -849 -432 274 620 590 459 351 -141 -538 -398 -300 37 484 541 69 -368 -1020 -1415 -878 -541 -896 -985 -545 -256 493 878 824 570 364 9 -130 -53 144 401 415 328 423 603 663 630 569 163 166 306 253 78 -229 -407 -229 19 43 108 402 297 100 -2 -429 -817 -870 -389 -300 -358 -564 -700 -660 -575 -516 -497 -734 -804 -734 -536 -309 -88 -23 34 182 315 350 354 336 336 273 255 157 -130 -436 -352 -175 -38 184 48 -588 -1095 -1125 -985 -550 -38 -106 -202 48 99 198 300 360 206 -26 -106 212 439 662 850 870 704 749 550 230 99 418 948 1378 1746 1471 620 16 -297 -78 568 1033 661 681 526 260 -198 -871 -1252 -1449 -1542 -1427 -1560 -1978 -2092 -1884 -935 -482 319 741 705 528 395 -154 -554 -405 -323 42 584 687 89 -490 -1289 -1745 -1032 -651 -1105 -1288 -716 -354 689 1308 1243 873 541 13 -185 -72 194 565 597 496 626 914 978 892 799 220 227 409 362 116 -344 -635 -369 31 71 186 686 516 173 -3 -729 -1348 -1424 SS 20251015T133113.4Z 9419.563349 294 1 51.58 2 66.78 124.40 23.27 211.88 0.00 1 0.00 1 0 17 1.485e-02 7.554e-03 4.726e-04 1.753e-04 2.873727e-01 9.113362e-05 3.385777e-03 -6.000000e+00 8.825135e-03 226.20 -2.00 3.48 -2.00 316.96 0.00e+00 9.200390e-04 1.236969e-05 2.602192e-04 -6.000000e+00 3.984871e-04 285.46 -2.00 20.00 -2.00 316.17 0.00e+00 2.517 0.000 302.00 328.00 3 1.7488e-01 2.3853e-04 2.8877e-02 -6.0000e+00 2.1795e-02 -3.3836e-03 2.6851e-04 1.4421e-02 -6.0000e+00 2.3673e-02 -1.1596e-03 1.5713e-04 7.0670e-03 -6.0000e+00 1.4157e-02 -4.7023e-03 7.4362e-05 2.0140e-03 -6.0000e+00 5.9169e-03 2.6204e-02 -1.0951e-04 5.5208e-06 2.5487e-05 -6.0000e+00 4.5942e-04 1.0216e-02 3.7497e-06 11 8 0 10 0 0 20.72 23.58 0.45 0.01022 0.00939 1899 309 1 5 0 27.160 26.32 20.01 23.58 24.93 7.5 996.68 -2018 -1408 -2274 -4015 -5303 -5131 -4022 -3044 -2835 -4029 -4737 -4117 -2572 -1293 73 114 395 986 1504 1588 1517 1381 1622 1345 1080 848 -236 -1128 -803 -272 117 872 274 -1737 -3251 -3317 -2635 -1453 -156 -287 -505 -107 34 199 304 498 111 -125 -153 308 672 1078 1276 1235 1014 1012 762 229 118 548 1234 1889 2147 1621 722 -96 -475 -126 655 1186 723 653 531 279 -199 -1009 -1604 -1860 -1840 -1666 -1805 -1930 -1993 -1682 -876 -441 233 613 485 448 340 -91 -481 -279 -208 92 490 523 60 -366 -1041 -1369 -808 -517 -915 -950 -519 -234 481 845 793 557 337 -7 -106 -18 187 419 459 347 420 550 624 674 643 231 222 334 291 55 -203 -419 -226 -21 51 119 389 255 111 -3 -454 -831 -875 -258 -180 -304 -578 -711 -657 -529 -437 -408 -622 -752 -678 -464 -266 17 29 100 259 411 449 438 402 482 421 356 291 -82 -379 -256 -86 39 311 98 -651 -1202 -1219 -1039 -655 -77 -152 -297 -62 21 121 185 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