File name: Pandora236s1_NewLondonCT_20250313_L2Fit_fout2c4d20220606p1-8.txt File generation date: 20250314T050604.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Brooke S.Stutzman Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 236 Spectrometer number: 1 Processing software version used: BlickP v1.8.74 Instrument operation file used: Pandora236_OF_v3d20220107.txt Instrument calibration file used: Pandora236s1_CF_v4d20220606.txt Level 1 file used: Pandora236s1_NewLondonCT_20250313_L1_smca1c4d20220606p1-8.txt Full location name: United States Coast Guard Academy Short location name: NewLondonCT Country of location: United States Location latitude [deg]: 41.3758 Location longitude [deg]: -72.1004 Location altitude [m]: 30 Local noon date: 20250313 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: Modification of session 3 "1.8 field calibration all gases" change in SO2 First and last pixel inside fitting window: 197 338 Nominal wavelengths inside fitting window [nm]: 305.1267 305.2679 305.4091 305.5502 305.6914 305.8325 305.9737 306.1148 306.2559 306.3970 306.5381 306.6792 306.8203 306.9613 307.1024 307.2434 307.3845 307.5255 307.6665 307.8075 307.9485 308.0894 308.2304 308.3714 308.5123 308.6532 308.7942 308.9351 309.0760 309.2169 309.3577 309.4986 309.6395 309.7803 309.9211 310.0620 310.2028 310.3436 310.4844 310.6251 310.7659 310.9067 311.0474 311.1881 311.3289 311.4696 311.6103 311.7510 311.8916 312.0323 312.1730 312.3136 312.4543 312.5949 312.7355 312.8761 313.0167 313.1573 313.2978 313.4384 313.5790 313.7195 313.8600 314.0005 314.1410 314.2815 314.4220 314.5625 314.7029 314.8434 314.9838 315.1243 315.2647 315.4051 315.5455 315.6859 315.8262 315.9666 316.1070 316.2473 316.3876 316.5279 316.6682 316.8085 316.9488 317.0891 317.2294 317.3696 317.5099 317.6501 317.7903 317.9305 318.0707 318.2109 318.3511 318.4912 318.6314 318.7715 318.9117 319.0518 319.1919 319.3320 319.4721 319.6121 319.7522 319.8923 320.0323 320.1723 320.3124 320.4524 320.5924 320.7323 320.8723 321.0123 321.1522 321.2922 321.4321 321.5720 321.7119 321.8518 321.9917 322.1316 322.2715 322.4113 322.5512 322.6910 322.8308 322.9706 323.1104 323.2502 323.3900 323.5297 323.6695 323.8092 323.9490 324.0887 324.2284 324.3681 324.5078 324.6474 324.7871 324.9268 --------------------------------------------------------------------------------------- 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 20250313T121016.1Z 9203.507131 261 1 28.63 2 78.36 104.23 104.77 292.93 0.00 1 0.00 1 0 17 3.797e-01 1.108e-02 2.013e-01 5.322e-03 6.414889e-01 2.838244e-03 7.421672e-03 -6.000000e+00 2.129743e-01 226.02 -2.00 3.52 -2.00 321.10 0.00e+00 2.293237e-03 1.246551e-03 2.624911e-03 -6.000000e+00 9.271128e-03 276.46 -2.00 20.00 -2.00 320.59 0.00e+00 4.798 0.002 302.00 328.00 3 2.3561e+00 9.1833e-03 5.9470e-02 -6.0000e+00 5.2843e-01 1.4404e-01 1.2360e-02 3.7094e-02 -6.0000e+00 5.7521e-01 -1.8205e-01 1.2739e-02 2.0390e-02 -6.0000e+00 3.4188e-01 6.6068e-02 6.1895e-03 6.6697e-03 -6.0000e+00 1.4768e-01 2.1253e-04 -2.5388e-04 1.4927e-04 9.3508e-05 -6.0000e+00 9.8797e-03 5.9450e-04 0.0000e+00 12 9 9 12 1 1 95.18 23.58 0.32 0.00059 -0.00131 29 9 1 5 0 954.340 25.90 20.00 23.58 10.08 15.7 943.47 900000 -185716 -111023 -147546 42426 -79098 -125865 -90097 -116133 -30836 -121559 -86566 -146144 -13631 -65650 -4070 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-1275 -58 -823 232 -806 -1574 -1025 -1071 -1264 188 188 -867 1393 -238 810 -759 400 -1430 107 723 -105 755 279 188 -1878 -821 -2514 -354 -1552 -1235 -2136 571 482 616 1015 -377 130 -406 64 -324 1414 296 430 -105 1760 1190 750 688 814 200 1319 679 -651 -561 -1327 -370 -137 699 -503 -33 791 490 -243 -452 -581 -652 SS 20250313T121513.4Z 9203.510572 264 1 51.29 2 77.46 105.10 105.61 293.80 0.00 1 0.00 1 0 17 2.586e-01 8.130e-03 2.473e-01 4.705e-03 5.999481e-01 2.514133e-03 6.938108e-03 -6.000000e+00 1.450273e-01 226.02 -2.00 3.52 -2.00 321.16 0.00e+00 3.069062e-03 1.098940e-03 2.384112e-03 -6.000000e+00 6.313578e-03 276.46 -2.00 20.00 -2.00 320.65 0.00e+00 4.479 0.002 302.00 328.00 3 2.6311e+00 8.1125e-03 5.5262e-02 -6.0000e+00 3.5984e-01 8.6832e-02 1.0916e-02 3.3978e-02 -6.0000e+00 3.9170e-01 -1.0089e-01 1.1330e-02 1.9634e-02 -6.0000e+00 2.3281e-01 3.2405e-02 5.5350e-03 7.1526e-03 -6.0000e+00 1.0056e-01 2.2893e-04 -3.2814e-04 1.3587e-04 9.1757e-05 -6.0000e+00 6.7280e-03 9.0343e-04 0.0000e+00 11 8 0 10 0 0 99.98 23.58 0.35 0.00090 -0.00156 74 13 1 5 0 693.040 26.00 20.00 23.58 10.46 15.9 947.72 900000 -19326 -53310 146125 -455 -83306 -26315 -147303 16349 -124610 26321 -74358 23497 -36357 -17620 -36451 4347 1716 -29305 8332 -22992 -925 -30259 -5756 -38358 26224 -28355 4472 -41947 32383 -22257 5042 -21538 -9720 3019 -4690 314 -4531 13661 -6022 338 -723 7049 -1359 12222 -4201 4003 3971 3748 8195 179 6643 4483 3048 3319 -143 665 4221 -3128 3116 3232 3370 5385 852 1549 1687 -1931 396 4263 -354 1745 -1656 948 1077 -779 -2017 -1395 -283 -1043 -1508 -3623 -201 -1312 -375 -1132 208 58 2592 214 283 -4 -377 -1094 -867 -900 -155 1728 276 -311 -720 -950 -921 388 -1008 -1696 -1509 -508 151 243 489 201 338 -425 264 -234 648 233 708 791 -208 296 535 410 294 651 -900 642 -263 -5 -136 -272 -549 -179 -294 -184 -101 649 174 -178 431 -423 -158 900000 -89 -356 670 -2 -660 -132 -2825 75 -2234 121 -1023 157 -561 -279 -805 71 31 -782 160 -604 -20 -934 -151 -1487 558 -1029 112 -1696 716 -1021 206 -1302 -519 133 -237 17 -321 991 -566 32 -74 698 -148 1186 -491 441 454 450 1027 27 1046 786 582 658 -30 142 849 -659 623 695 818 1457 262 466 488 -584 124 1486 -146 750 -743 397 416 -274 -655 -439 -95 -413 -707 -1993 -119 -832 -251 -819 156 46 2000 165 203 -3 -239 -693 -598 -715 -141 1775 320 -369 -814 -976 -851 346 -984 -1776 -1654 -588 188 335 749 330 557 -682 396 -334 908 341 1096 1291 -344 472 821 609 418 889 -1195 851 -393 -9 -251 -535 -1131 -387 -683 -453 -253 1648 448 -443 1003 -938 -335 SS 20250313T123851.3Z 9203.526983 273 1 51.29 2 73.22 109.34 109.54 298.10 0.00 1 0.00 1 0 17 7.057e-02 5.744e-03 1.598e-02 9.842e-04 4.597871e-01 4.967514e-04 5.364693e-03 -6.000000e+00 3.958289e-02 226.02 -2.00 3.52 -2.00 319.91 0.00e+00 1.784344e-03 1.518958e-04 7.870626e-04 -6.000000e+00 1.710814e-03 276.46 -2.00 20.00 -2.00 319.35 0.00e+00 3.411 0.001 302.00 328.00 3 1.5433e+00 1.4269e-03 4.1428e-02 -6.0000e+00 9.8215e-02 3.9459e-02 1.7079e-03 2.3902e-02 -6.0000e+00 1.0689e-01 -3.0160e-02 1.4680e-03 1.2440e-02 -6.0000e+00 6.3493e-02 1.3088e-03 7.6635e-04 4.1150e-03 -6.0000e+00 2.7215e-02 2.2045e-03 -2.7210e-04 2.7909e-05 4.2266e-05 -6.0000e+00 1.8303e-03 1.2500e-04 0.0000e+00 10 0 0 10 0 0 98.29 23.57 0.26 0.00012 -0.00192 229 39 1 5 0 223.930 26.00 20.00 23.57 12.21 16.0 958.55 -28067 -15688 -28188 -22102 -28740 -18266 -20866 -27346 -24943 -19275 -19058 -12038 -10151 -6673 -3913 -8730 -3506 -4891 -191 -1505 -2591 -1164 -2235 -1422 -2594 -3406 -5408 -3483 -6820 -2439 -3418 1068 -1057 -4055 -5669 -2614 -3401 -44 -1126 -241 -267 -1082 -340 166 1742 277 1070 -77 -418 1193 1759 1785 1765 1352 1369 1605 22 309 79 410 1005 2035 2341 1489 -50 499 -808 1000 1290 993 967 604 757 80 -965 -1081 -1910 -1121 -677 -1443 -586 -2020 -1719 -1097 -687 22 -61 990 625 567 317 -340 -287 -67 -71 239 1149 588 21 -422 -938 -812 49 -885 -1325 -965 -719 -237 485 290 354 136 47 -67 208 359 234 406 78 -160 277 590 269 589 208 -278 928 214 -211 -101 -539 -412 -169 -151 -85 -127 577 50 12 16 -323 -113 -514 -280 -582 -390 -496 -293 -382 -611 -606 -459 -463 -314 -320 -248 -170 -446 -183 -279 -11 -92 -160 -71 -148 -101 -197 -272 -432 -257 -514 -193 -315 107 -121 -469 -622 -293 -442 -7 -192 -47 -56 -240 -77 38 396 65 247 -18 -102 305 495 545 581 474 496 599 8 115 29 151 395 880 1125 769 -25 237 -383 487 716 623 645 409 494 49 -537 -543 -924 -562 -389 -969 -442 -1705 -1524 -1027 -632 22 -61 997 617 569 294 -295 -242 -60 -72 251 1360 771 28 -535 -1092 -858 51 -1003 -1609 -1221 -962 -337 746 451 578 220 72 -105 305 517 351 647 123 -256 468 964 425 885 300 -385 1271 322 -354 -168 -953 -752 -322 -307 -182 -259 1196 104 26 33 -647 -217 SS 20250313T124403.3Z 9203.530593 277 1 51.13 2 72.30 110.31 110.38 299.08 0.00 1 0.00 1 0 17 5.687e-02 5.807e-03 1.250e-02 9.062e-04 4.373677e-01 4.593510e-04 5.106733e-03 -6.000000e+00 3.190273e-02 226.02 -2.00 3.52 -2.00 319.77 0.00e+00 1.628182e-03 1.323199e-04 6.128889e-04 -6.000000e+00 1.378823e-03 276.46 -2.00 20.00 -2.00 319.20 0.00e+00 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