File name: Pandora32s1_GreenbeltMD_20240907_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240908T051008.9Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240907_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: 20240907 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 20240907T121522.7Z 9016.510679 79 1 48.72 2 72.77 96.65 120.38 85.41 0.00 1 0.00 1 0 17 4.516e-02 5.619e-03 2.280e-02 1.877e-03 4.304059e-01 9.598957e-04 4.982885e-03 -6.000000e+00 2.599941e-02 229.81 -2.00 3.47 -2.00 319.34 0.00e+00 9.278748e-04 2.565703e-04 3.421039e-04 -6.000000e+00 1.168133e-03 289.25 -2.00 20.00 -2.00 318.53 0.00e+00 3.326 0.001 302.00 328.00 3 3.2140e+00 2.7175e-03 3.9800e-02 -6.0000e+00 6.4786e-02 9.8435e-03 3.1978e-03 2.2356e-02 -6.0000e+00 7.0064e-02 -4.3835e-03 2.4087e-03 1.1017e-02 -6.0000e+00 4.1845e-02 -3.6612e-03 1.2671e-03 3.2170e-03 -6.0000e+00 1.7898e-02 4.7314e-04 9.5760e-05 5.3478e-05 3.3724e-05 -6.0000e+00 1.2034e-03 6.7051e-03 -2.1673e-05 12 1 1 12 4 4 99.98 -62.18 0.20 0.00671 0.00742 107 25 1 5 0 455.280 26.51 20.00 -62.18 25.26 5.1 1007.50 -9315 -10712 -15841 -10338 -22678 -18068 2146 -15148 -5221 -20747 -11561 -13465 -339 -655 -7366 2317 -4299 4431 -243 6333 -519 -3070 2116 -4490 1365 -748 440 -873 -6564 -869 -3302 -462 4924 -2860 -1481 -4457 -1259 -2665 -2307 702 -761 668 -3092 263 338 1278 205 196 -892 -1283 937 1574 1508 1076 558 1425 656 -531 516 434 860 692 1923 2417 942 -366 -401 180 418 1329 444 65 24 109 309 -318 -734 -1376 -1202 -621 -1304 -799 -1848 -1779 -704 -639 205 33 709 609 395 1237 -502 893 532 340 392 637 203 -67 -220 -1279 -665 -96 -690 -1247 -855 -556 -273 279 521 475 609 298 132 26 240 -16 -146 16 -533 48 161 225 242 162 113 624 563 224 167 -171 -465 -17 -107 27 -188 126 202 -63 114 -318 -247 -197 -265 -441 -272 -617 -445 46 -425 -152 -755 -398 -491 -13 -29 -413 137 -296 301 -18 474 -43 -261 175 -421 131 -77 46 -90 -681 -86 -360 -56 634 -424 -212 -632 -183 -453 -469 164 -202 187 -932 79 102 387 63 60 -280 -413 315 572 589 449 245 642 306 -251 239 198 398 340 1025 1393 572 -219 -228 100 245 860 317 49 18 81 215 -205 -438 -797 -722 -415 -986 -661 -1657 -1664 -686 -657 219 37 783 661 409 1200 -465 803 502 352 446 788 269 -90 -285 -1559 -761 -110 -834 -1589 -1126 -758 -388 419 827 777 992 471 199 38 343 -23 -225 25 -871 78 254 346 361 235 159 872 831 355 279 -295 -820 -31 -202 53 -376 256 412 -126 222 -604 -458 SS 20240907T122053.7Z 9016.514510 83 1 48.35 2 71.71 97.56 119.36 86.31 0.00 1 0.00 1 0 17 5.372e-02 6.563e-03 4.199e-02 3.575e-03 4.079397e-01 1.828861e-03 4.702492e-03 -6.000000e+00 3.095345e-02 229.81 -2.00 3.47 -2.00 319.33 0.00e+00 1.158685e-03 4.838029e-04 1.957248e-04 -6.000000e+00 1.389794e-03 289.25 -2.00 20.00 -2.00 318.52 0.00e+00 3.144 0.000 302.00 328.00 3 4.4598e+00 5.1735e-03 3.7637e-02 -6.0000e+00 7.7131e-02 2.1199e-02 6.0787e-03 2.1165e-02 -6.0000e+00 8.3395e-02 8.7403e-03 4.5293e-03 1.0434e-02 -6.0000e+00 4.9809e-02 -1.0530e-02 2.3794e-03 3.2760e-03 -6.0000e+00 2.1317e-02 1.6426e-04 5.9102e-04 1.0281e-04 3.3087e-05 -6.0000e+00 1.4313e-03 5.5008e-03 1.1181e-04 12 9 1 12 4 4 100.00 -62.18 0.27 0.00550 0.00994 48 11 1 5 0 1007.060 26.51 20.00 -62.18 25.41 5.1 1008.10 3424 -32210 -1687 -10555 -15559 -6163 -153 24038 -21378 -4552 -8591 -14606 5890 -7797 6499 3500 -857 3499 -3896 18805 -9593 -2867 3436 -7135 903 -3641 7103 -3247 852 -7352 -1136 5070 10570 -542 -4211 -3840 -6247 375 -2333 -604 -81 -1693 -4053 1313 288 1863 608 1858 -1208 -617 495 2539 691 -296 1191 -378 1238 -244 -400 1880 602 2804 1879 1966 -141 -1470 391 -25 1328 1422 251 -223 140 657 -1005 -393 -1070 605 -1237 -750 -1210 -1329 -1856 -1778 -163 -481 -697 553 150 610 688 2077 -307 242 664 558 54 1081 225 -539 -81 -882 -932 360 -438 -1045 -521 -783 -90 273 1 344 0 546 369 216 483 -281 -69 -121 -398 95 21 86 170 232 -387 1092 34 517 437 -655 -164 174 66 108 -153 -226 165 -179 281 -38 -436 72 -1075 -46 -308 -439 -150 -4 518 -787 -156 -313 -582 221 -394 341 217 -61 253 -322 1322 -911 -257 295 -716 91 -404 729 -356 86 -796 -125 594 1316 -80 -631 -551 -965 63 -481 -145 -22 -492 -1254 396 89 569 189 570 -383 -198 167 916 272 -125 521 -173 574 -115 -187 846 279 1355 1004 1141 -87 -886 219 -14 761 910 179 -168 106 481 -706 -252 -633 339 -727 -492 -900 -1094 -1650 -1655 -158 -494 -753 611 167 665 712 1993 -281 215 618 569 61 1328 298 -727 -105 -1065 -1058 405 -525 -1328 -684 -1073 -129 413 2 569 0 865 553 309 682 -411 -106 -194 -651 154 33 132 253 334 -538 1500 50 811 725 -1130 -287 315 125 213 -310 -462 340 -365 553 -73 -814 SS 20240907T122557.5Z 9016.518026 86 1 43.32 2 70.74 98.41 118.43 87.13 0.00 1 0.00 1 0 17 2.656e-02 5.514e-03 3.825e-03 5.658e-04 3.881358e-01 2.875508e-04 4.538846e-03 -6.000000e+00 1.529293e-02 229.81 -2.00 3.47 -2.00 318.46 0.00e+00 8.297314e-04 5.879522e-05 2.314238e-04 -6.000000e+00 6.871406e-04 289.25 -2.00 20.00 -2.00 317.62 0.00e+00 2.995 0.000 302.00 328.00 3 1.3596e+00 7.8326e-04 3.5831e-02 -6.0000e+00 3.8107e-02 1.3854e-03 8.9638e-04 2.0069e-02 -6.0000e+00 4.1213e-02 -1.3950e-02 6.0142e-04 9.7944e-03 -6.0000e+00 2.4614e-02 1.7309e-03 3.1521e-04 2.7922e-03 -6.0000e+00 1.0527e-02 4.4085e-03 -6.1565e-05 1.5924e-05 2.9340e-05 -6.0000e+00 7.0792e-04 6.5685e-03 -4.8653e-05 12 1 1 12 5 5 99.98 -62.18 0.27 0.00657 0.00611 379 100 1 5 0 113.990 26.51 20.00 -62.18 25.56 5.1 1009.30 -7555 -8416 -6497 -8450 -10569 -10816 -10874 -6907 -6839 -4946 -9120 -7045 -4764 -3340 -3 -496 591 223 1500 1570 325 192 144 287 -92 -220 -439 -1883 -1605 -1452 260 314 1488 -162 -2836 -2490 -2995 -1448 -252 -129 -703 -558 -314 -285 158 287 -120 -55 -621 -324 688 1111 723 1168 831 889 951 323 234 409 873 1299 1616 1933 1080 68 180 -399 559 962 313 217 45 198 -38 -251 -717 -1179 -930 -770 -1145 -1251 -1807 -1890 -807 -605 -76 240 333 613 478 843 -83 401 534 193 261 478 320 -226 -402 -960 -862 -45 -516 -1158 -674 -700 -127 403 368 374 277 404 103 337 280 175 55 9 -384 -42 174 150 449 477 -84 924 480 267 244 -217 -267 -36 55 -70 -105 199 3 -116 17 -332 -509 -304 -397 -321 -419 -486 -465 -485 -335 -378 -292 -573 -447 -336 -278 0 -55 71 26 186 204 44 26 20 42 -15 -37 -76 -319 -256 -229 43 59 309 -37 -641 -536 -685 -380 -73 -45 -278 -219 -128 -119 66 121 -50 -23 -262 -138 309 544 384 615 462 510 560 193 137 235 509 808 1106 1355 795 48 120 -278 381 744 256 188 40 168 -30 -191 -497 -831 -637 -599 -966 -1123 -1776 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