File name: Pandora32s1_GreenbeltMD_20250216_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250217T052600.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora32_OF_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250216_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20250216 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: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- 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 20250216T172909.7Z 9178.728584 429 1 12.57 2 51.09 182.44 132.35 300.18 0.00 1 0.00 1 0 17 8.372e-03 5.777e-03 2.798e-03 1.631e-03 2.192693e-01 8.266443e-04 2.647149e-03 -6.000000e+00 4.741439e-03 225.04 -2.00 3.47 -2.00 315.65 0.00e+00 1.953869e-04 7.943335e-05 3.299307e-05 -6.000000e+00 2.057310e-04 276.47 -2.00 20.00 -2.00 315.10 0.00e+00 1.589 0.000 302.00 328.00 3 3.9135e+00 2.1189e-03 1.9135e-02 -6.0000e+00 1.1736e-02 2.0102e-02 2.3631e-03 1.0949e-02 -6.0000e+00 1.2764e-02 -4.3023e-03 1.3653e-03 5.4331e-03 -6.0000e+00 7.5881e-03 -2.2349e-03 6.2927e-04 1.5537e-03 -6.0000e+00 3.2664e-03 1.7182e-03 3.4268e-05 4.5785e-05 1.9192e-05 -6.0000e+00 2.2452e-04 -6.2486e-03 -6.3751e-06 12 1 1 12 1 1 97.99 20.78 0.38 -0.00625 -0.00599 13 13 1 5 0 897.760 25.79 19.98 20.78 15.00 5.4 951.80 900000 -719 -1047 -2840 -2804 -2400 -635 1052 944 -981 -1875 -851 -563 447 422 417 -706 191 780 1502 1196 849 1417 659 346 51 175 -512 -625 291 1286 1657 1535 342 -1754 -1918 -1916 -1196 4 -30 -543 -483 -633 -483 -172 -481 -615 -399 -322 -540 763 597 487 1246 577 841 762 120 576 649 1149 1259 1189 965 494 -411 -402 -176 493 853 155 -268 -377 304 177 187 -435 -753 -897 -302 -1274 -1075 -1606 -1974 -816 -829 -304 -183 81 305 491 715 97 343 567 515 71 535 579 -204 -301 -531 -644 8 -381 -855 -652 -538 -87 286 185 439 293 398 28 108 216 465 330 142 -387 120 94 175 476 639 -22 710 583 139 163 -310 -241 40 32 -34 -157 136 85 -18 -205 -325 -689 900000 -189 -288 -769 -677 -523 -137 246 250 -285 -549 -243 -171 140 151 154 -277 76 320 630 518 367 607 295 165 24 83 -249 -281 123 543 747 747 166 -833 -918 -948 -626 2 -19 -395 -350 -474 -366 -130 -362 -457 -287 -237 -392 561 443 384 1024 468 693 642 102 480 531 947 1096 1066 931 467 -388 -361 -148 423 775 151 -278 -396 310 171 172 -379 -639 -760 -265 -1208 -1075 -1741 -2148 -929 -971 -362 -226 102 373 585 811 104 346 582 549 80 668 748 -270 -377 -640 -756 10 -462 -1070 -851 -704 -117 393 270 630 427 542 36 136 273 580 439 196 -538 166 133 237 638 814 -28 868 745 184 219 -429 -337 57 47 -51 -241 213 130 -28 -314 -480 -1027 SS 20250216T180206.0Z 9178.751459 448 1 10.65 2 51.93 192.68 137.53 308.55 0.00 1 0.00 1 0 17 9.284e-03 6.639e-03 6.864e-03 3.652e-03 2.202124e-01 1.844973e-03 2.660000e-03 -6.000000e+00 5.261013e-03 225.05 -2.00 3.47 -2.00 315.93 0.00e+00 4.721442e-04 1.894026e-04 3.579951e-05 -6.000000e+00 2.281179e-04 276.47 -2.00 20.00 -2.00 315.37 0.00e+00 1.618 0.000 302.00 328.00 3 5.0329e+00 4.7494e-03 1.9414e-02 -6.0000e+00 1.3023e-02 2.4464e-02 5.3016e-03 1.1048e-02 -6.0000e+00 1.4160e-02 -1.1314e-03 3.0727e-03 5.4786e-03 -6.0000e+00 8.4183e-03 -4.7249e-03 1.4378e-03 1.6106e-03 -6.0000e+00 3.6258e-03 5.4258e-04 4.3279e-04 1.0284e-04 1.9093e-05 -6.0000e+00 2.4896e-04 -7.6942e-03 9.3327e-05 12 9 1 12 9 1 99.94 20.95 0.38 -0.00769 -0.00444 3 4 1 5 0 2662.020 25.90 19.97 20.95 15.90 5.4 957.22 900000 617 -170 -1071 -1344 -1098 -470 337 238 -777 -1371 -3884 2152 531 -677 -701 -998 -113 1112 -3 1676 973 2483 -753 1669 -257 461 245 -498 -839 1384 1511 1369 -636 -1744 -3362 -1593 -1733 546 -953 1 -534 752 -656 -43 -460 391 -847 320 -850 -526 986 649 1243 456 117 669 -342 101 101 631 980 1410 1195 -314 -36 370 -147 171 1083 382 -229 -481 747 -304 -236 -46 -533 -1321 -794 -1013 -664 -2318 -1398 -1427 -195 -241 69 617 594 292 856 29 554 769 898 487 765 954 -454 14 -643 -1109 525 -455 -1304 -827 -533 -246 298 302 301 98 518 108 43 718 10 -146 263 -329 -236 265 20 92 285 -367 803 591 855 -503 91 -719 -12 433 -439 -336 -243 492 324 -18 -89 -567 900000 137 -40 -246 -281 -211 -90 70 55 -193 -343 -979 546 152 -217 -245 -367 -42 422 -1 665 388 975 -312 709 -115 207 107 -206 -335 548 631 608 -298 -804 -1494 -717 -861 304 -604 1 -379 542 -482 -31 -337 283 -606 223 -590 -371 720 495 975 369 96 554 -286 83 82 519 835 1261 1121 -302 -34 322 -123 146 982 373 -233 -496 753 -299 -218 -40 -437 -1084 -692 -954 -666 -2462 -1520 -1608 -227 -293 86 770 734 347 965 31 564 793 974 564 939 1226 -593 18 -777 -1289 606 -552 -1660 -1077 -711 -336 420 440 444 143 727 145 55 899 12 -194 364 -469 -337 372 28 123 371 -464 994 752 1134 -694 127 -1018 -18 639 -672 -525 -384 781 511 -29 -136 -851 SS 20250216T180705.0Z 9178.754919 451 1 4.75 2 52.15 194.20 138.27 309.94 0.00 1 0.00 1 0 17 8.579e-03 5.859e-03 5.318e-03 2.976e-03 2.220202e-01 1.501744e-03 2.692948e-03 -6.000000e+00 4.856598e-03 225.05 -2.00 3.47 -2.00 315.71 0.00e+00 3.730093e-04 1.469888e-04 3.056968e-05 -6.000000e+00 2.102963e-04 276.47 -2.00 20.00 -2.00 315.17 0.00e+00 1.626 0.000 302.00 328.00 3 3.9414e+00 3.8570e-03 1.9536e-02 -6.0000e+00 1.2021e-02 1.8821e-02 4.3028e-03 1.1136e-02 -6.0000e+00 1.3067e-02 -3.5207e-03 2.4817e-03 5.5288e-03 -6.0000e+00 7.7741e-03 -1.6821e-03 1.1426e-03 1.5957e-03 -6.0000e+00 3.3240e-03 1.5933e-03 -2.7141e-04 8.3170e-05 1.9413e-05 -6.0000e+00 2.2813e-04 -6.0131e-03 -4.6531e-05 12 1 1 12 1 1 84.51 20.97 0.30 -0.00601 -0.00805 4 12 1 5 0 948.080 25.90 20.10 20.97 15.94 5.4 957.67 -62 1370 -1155 -1522 -3560 -3068 -1054 733 1347 -1272 -893 -52 -955 1126 404 402 -159 537 533 143 2288 669 1135 387 -41 746 380 -199 -678 59 952 334 1833 -896 -1263 -2011 -1700 -825 -730 -662 -1200 -556 -532 -97 -782 -686 -243 -1009 -756 -96 1149 922 513 1154 669 853 1281 -144 339 404 930 1444 1273 1239 536 -466 -218 -521 519 1220 -179 476 233 -285 365 57 -914 -117 -1044 -208 -837 -1174 -1590 -1747 -592 -617 -210 -428 114 -138 99 597 218 566 764 390 377 379 521 -272 -232 -656 -189 188 -485 -811 -293 -607 -284 37 285 -162 506 118 47 310 70 193 487 -158 -182 -266 370 150 873 678 105 840 255 296 -441 120 -280 172 51 15 -294 86 -50 35 6 -201 -766 -14 335 -298 -385 -838 -664 -226 168 340 -347 -244 -14 -272 349 139 150 -62 213 217 60 964 284 480 169 -19 350 181 -92 -298 25 404 149 859 -444 -612 -937 -810 -429 -428 -434 -848 -406 -396 -73 -589 -515 -181 -740 -544 -68 824 690 400 925 549 709 1076 -122 285 336 778 1246 1156 1173 518 -438 -193 -446 448 1121 -177 485 240 -292 360 53 -804 -97 -873 -184 -797 -1190 -1692 -1912 -666 -723 -255 -532 143 -171 118 675 233 582 795 427 438 465 669 -353 -294 -793 -219 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