File name: Pandora134s1_BristolPA_20250814_L2Fit_fout2c5d20230501p1-8.txt File generation date: 20250815T051719.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 134 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora134_OF_v6d20200325.txt Instrument calibration file used: Pandora134s1_CF_v5d20230501.txt Level 1 file used: Pandora134s1_BristolPA_20250814_L1_smca1c5d20230501p1-8.txt Full location name: Bristol, Pennsylvania; Philadelphia-Camden-Wilmington, PA-NJ-DE-MD; A420170012 Short location name: BristolPA Country of location: United States Location latitude [deg]: 40.1074 Location longitude [deg]: -74.8824 Location altitude [m]: 10 Local noon date: 20250814 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Based on session 3 for VP from 20230501 First and last pixel inside fitting window: 234 375 Nominal wavelengths inside fitting window [nm]: 305.0892 305.2306 305.3720 305.5133 305.6546 305.7959 305.9373 306.0785 306.2198 306.3611 306.5024 306.6436 306.7849 306.9261 307.0673 307.2085 307.3497 307.4909 307.6320 307.7732 307.9144 308.0555 308.1966 308.3377 308.4788 308.6199 308.7610 308.9021 309.0431 309.1842 309.3252 309.4662 309.6073 309.7483 309.8893 310.0302 310.1712 310.3122 310.4531 310.5940 310.7350 310.8759 311.0168 311.1577 311.2985 311.4394 311.5803 311.7211 311.8619 312.0027 312.1436 312.2844 312.4251 312.5659 312.7067 312.8474 312.9882 313.1289 313.2696 313.4103 313.5510 313.6917 313.8324 313.9730 314.1137 314.2543 314.3950 314.5356 314.6762 314.8168 314.9574 315.0979 315.2385 315.3790 315.5196 315.6601 315.8006 315.9411 316.0816 316.2221 316.3625 316.5030 316.6435 316.7839 316.9243 317.0647 317.2051 317.3455 317.4859 317.6262 317.7666 317.9069 318.0473 318.1876 318.3279 318.4682 318.6085 318.7488 318.8890 319.0293 319.1695 319.3097 319.4500 319.5902 319.7304 319.8705 320.0107 320.1509 320.2910 320.4312 320.5713 320.7114 320.8515 320.9916 321.1317 321.2717 321.4118 321.5518 321.6919 321.8319 321.9719 322.1119 322.2519 322.3919 322.5318 322.6718 322.8117 322.9516 323.0916 323.2315 323.3714 323.5112 323.6511 323.7910 323.9308 324.0707 324.2105 324.3503 324.4901 324.6299 324.7697 324.9094 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20250814T113447.3Z 9357.482491 238 1 25.31 2 75.13 83.80 41.51 241.25 0.00 1 0.00 1 0 17 1.994e-01 7.906e-03 1.464e-01 5.170e-03 4.901922e-01 2.703676e-03 5.641233e-03 -6.000000e+00 1.144026e-01 231.80 -2.00 3.49 -2.00 320.39 0.00e+00 1.079639e-03 1.009770e-03 7.610823e-04 -6.000000e+00 5.125443e-03 290.76 -2.00 20.00 -2.00 319.63 0.00e+00 3.819 0.001 302.00 328.00 3 3.2140e+00 8.3960e-03 4.6460e-02 -6.0000e+00 2.8646e-01 6.1965e-04 1.0556e-02 2.6999e-02 -6.0000e+00 3.0931e-01 -2.6988e-02 9.1800e-03 1.2893e-02 -6.0000e+00 1.8442e-01 1.2027e-02 4.6533e-03 4.4389e-03 -6.0000e+00 7.9405e-02 2.6970e-04 -3.4383e-04 1.4687e-04 3.9682e-05 -6.0000e+00 5.1298e-03 -5.4764e-03 0.0000e+00 12 9 1 12 1 1 98.46 21.50 0.17 -0.00548 -0.00806 18 7 1 5 0 1331.944 27.15 20.00 21.50 31.61 34.2 1025.49 -80063 109420 -53351 -28978 -90561 -66859 -63814 -17605 -26602 30498 -56280 -47023 -53183 -19510 -908 14013 -2536 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20 21 1 5 0 434.908 27.26 20.01 21.53 32.07 34.3 1028.40 -8547 10623 -7883 -6366 -25049 -11350 -21686 -16220 -690 7090 49 -25349 8037 -7182 10657 -5805 8680 62 3104 2079 5197 -4713 9261 -7315 3685 -4924 4388 -5541 247 -3333 -177 -3752 1376 -3138 -3239 -6926 -5843 -534 -271 -127 -925 619 -128 1662 -1194 1668 -1997 1505 -2554 1883 -1205 1524 -311 1604 -609 1172 44 1284 -534 782 454 1713 2491 1859 554 173 -620 -768 1097 -267 671 -261 840 -35 -11 -1396 -1380 -2911 -664 -1951 -906 -1989 -1542 -1583 -58 -257 624 937 803 808 637 495 291 77 445 577 1322 1031 509 244 -418 -509 -474 -180 -1284 -579 -702 -181 -124 345 353 370 219 -244 -656 -618 -889 -350 -482 -282 -173 135 290 447 429 -15 439 811 716 38 367 -525 14 -74 123 -92 537 536 453 -381 -306 -1144 -159 183 -170 -127 -541 -232 -492 -403 -18 183 1 -907 273 -314 466 -339 472 4 204 145 358 -357 640 -650 315 -480 387 -510 21 -302 -18 -443 173 -420 -404 -907 -856 -90 -56 -30 -244 170 -37 471 -352 482 -597 436 -781 578 -419 565 -126 680 -274 537 21 592 -244 354 217 895 1316 1066 318 93 -322 -410 651 -183 492 -198 616 -25 -7 -804 -810 -1759 -405 -1403 -734 -1804 -1365 -1482 -58 -273 689 1049 887 843 614 476 267 73 437 642 1535 1335 686 316 -498 -593 -539 -219 -1584 -742 -950 -259 -179 540 585 614 348 -362 -978 -896 -1335 -519 -766 -462 -280 210 437 688 632 -21 603 1193 1091 64 640 -949 24 -138 244 -190 1121 1065 942 -763 -582 -2105 SS 20250814T115340.9Z 9357.495612 248 1 51.31 2 71.54 86.76 44.62 245.97 0.00 1 0.00 1 0 25 6.175e-02 6.810e-03 7.355e-02 3.823e-03 4.102331e-01 1.976883e-03 4.919704e-03 -6.000000e+00 3.542246e-02 231.80 -2.00 3.49 -2.00 319.93 0.00e+00 9.699253e-04 6.238507e-04 1.465509e-03 -6.000000e+00 1.586951e-03 290.76 -2.00 20.00 -2.00 319.12 0.00e+00 3.117 0.000 302.00 328.00 3 3.6779e+00 5.8643e-03 3.8881e-02 -6.0000e+00 8.8697e-02 1.3659e-04 7.0936e-03 2.4640e-02 -6.0000e+00 9.5770e-02 6.6566e-03 5.7176e-03 1.0739e-02 -6.0000e+00 5.7102e-02 -6.2046e-03 2.9686e-03 3.9294e-03 -6.0000e+00 2.4587e-02 3.6104e-04 -4.8504e-04 1.1069e-04 3.2327e-05 -6.0000e+00 1.5882e-03 -5.7790e-03 0.0000e+00 11 8 0 10 0 0 99.93 21.54 0.31 -0.00578 -0.00942 54 10 1 5 0 950.081 27.26 19.99 21.54 32.31 34.3 1030.26 -18235 17582 13373 -24716 15982 1698 34107 -10125 8932 -19184 14970 6651 13274 9529 21299 635 1436 8991 -2205 6702 844 10514 5181 1306 54 5284 -186 -1054 -13336 -497 -4645 452 -1582 1901 -6573 -8071 -6485 -1945 -3789 -441 -1131 633 -705 -1212 480 -833 477 446 -126 157 1029 246 1328 269 1891 24 -337 -424 502 -1033 1543 136 3341 1466 542 -483 -1110 -1254 318 659 326 254 1413 429 272 -1035 -534 -1524 -1224 -2147 -1679 -2159 -2074 -1250 -886 -33 400 492 1011 1504 1019 -84 395 396 161 1050 661 1447 252 671 -593 -212 -158 134 -697 -323 -624 -674 471 311 434 22 313 -116 -827 -585 -858 -839 -628 -565 -400 -388 418 369 498 86 499 388 901 41 58 -131 197 331 -237 -107 634 609 258 -225 -449 -943 -322 248 205 -513 205 25 400 -207 172 -509 291 151 339 304 719 29 71 443 -128 377 51 582 316 90 4 393 -15 -79 -1084 -37 -408 43 -171 203 -711 -898 -799 -277 -669 -88 -247 143 -167 -292 115 -205 116 108 -31 41 289 76 434 95 681 9 -131 -164 187 -393 602 59 1562 748 276 -232 -517 -598 167 394 211 169 910 265 154 -534 -256 -746 -668 -1365 -1196 -1703 -1734 -1091 -826 -33 410 513 1037 1463 921 -71 316 329 148 1080 761 1825 331 846 -698 -229 -167 150 -848 -407 -828 -941 701 500 729 38 507 -177 -1196 -825 -1246 -1290 -1023 -947 -665 -628 654 555 718 119 677 560 1417 69 103 -239 371 655 -497 -232 1385 1349 564 -477 -914 -1862 SS 20250814T120145.9Z 9357.501226 254 1 4.06 2 69.99 88.04 45.99 247.86 0.00 1 0.00 1 0 25 7.061e-02 9.618e-03 8.119e-02 8.397e-03 3.777122e-01 4.272393e-03 4.498183e-03 -6.000000e+00 4.050750e-02 231.80 -2.00 3.49 -2.00 318.79 0.00e+00 1.190044e-03 9.641949e-04 6.309171e-04 -6.000000e+00 1.814719e-03 290.76 -2.00 20.00 -2.00 317.93 0.00e+00 2.891 0.000 302.00 328.00 3 3.7030e+00 1.1834e-02 3.5352e-02 -6.0000e+00 1.0143e-01 1.0102e-02 1.3643e-02 2.0664e-02 -6.0000e+00 1.0952e-01 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