File name: Pandora32s1_GreenbeltMD_20230725_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20230727T212757.8Z 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 v1.8.49 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20230725_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: 20230725 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 20230725T113741.6Z 8606.484509 86 1 18.04 2 73.31 77.95 148.78 29.29 0.00 1 0.00 1 0 25 1.260e-01 6.994e-03 3.888e-02 2.649e-03 4.722905e-01 1.366043e-03 5.429736e-03 -6.000000e+00 7.304353e-02 232.35 -2.00 3.47 -2.00 319.42 0.00e+00 1.316895e-03 3.760908e-04 5.642494e-04 -6.000000e+00 3.271696e-03 290.45 -2.00 20.00 -2.00 318.59 0.00e+00 3.426 0.001 302.00 328.00 3 2.8831e+00 3.9048e-03 4.2157e-02 -6.0000e+00 1.8307e-01 1.6556e-03 4.6099e-03 2.4784e-02 -6.0000e+00 1.9775e-01 -1.9462e-02 3.5297e-03 1.2148e-02 -6.0000e+00 1.1794e-01 2.2108e-03 1.8514e-03 3.4928e-03 -6.0000e+00 5.0073e-02 5.6860e-04 -1.8584e-04 7.3981e-05 3.6627e-05 -6.0000e+00 3.3616e-03 2.8667e-02 1.1250e-04 12 9 1 12 5 1 99.95 26.86 0.34 0.02867 0.02727 24 16 1 5 0 715.070 31.30 25.00 26.86 29.60 3.1 1022.57 -70039 -48181 5132 -49049 -8067 -60440 32436 -45667 -34000 23032 -48415 -1512 -14916 3904 8255 -977 -3301 -8856 5936 -610 -3592 -5241 3530 5916 -5995 1314 3655 1361 -3187 -3197 9627 -7850 8561 -3440 -5702 -555 -5944 1822 -4375 2971 -2667 -1219 -1146 -720 5051 1423 1984 2128 -139 2354 -518 3339 575 1964 362 -52 1821 -387 726 -1099 1240 1515 334 2083 79 884 213 871 589 733 345 -466 148 190 -384 -891 -952 -433 -1574 -599 -1506 -981 -1914 -1509 139 -603 747 359 459 397 335 915 -345 812 -353 219 406 692 71 -736 -247 -1478 -592 -423 -1222 -729 -396 -740 18 340 617 113 445 217 458 402 83 371 -259 367 -571 -2 408 270 405 68 405 667 220 -7 78 -138 -430 313 -103 69 -135 -148 199 -192 -5 -147 -314 -1984 -1297 90 -1413 -146 -1704 405 -1342 -1021 440 -1860 -40 -520 139 339 -51 -193 -588 370 -42 -267 -397 253 445 -544 118 328 121 -285 -291 861 -942 999 -479 -790 -71 -856 285 -870 652 -685 -330 -323 -207 1395 410 575 619 -42 716 -173 1178 223 802 157 -23 827 -179 329 -498 564 733 178 1189 47 514 119 484 348 481 247 -349 111 138 -265 -571 -567 -252 -971 -411 -1160 -824 -1726 -1415 135 -618 790 391 501 425 342 883 -319 741 -343 231 468 863 94 -987 -317 -1798 -678 -488 -1491 -926 -519 -1006 25 509 972 184 718 340 687 583 120 551 -402 588 -929 -4 639 413 603 98 571 945 331 -11 131 -240 -765 572 -197 135 -271 -300 403 -385 -9 -277 -582 SS 20230725T114831.2Z 8606.492028 93 1 48.42 2 71.25 79.52 147.77 33.74 0.00 1 0.00 1 0 25 4.413e-02 5.529e-03 1.001e-02 1.098e-03 4.268675e-01 5.625211e-04 4.929080e-03 -6.000000e+00 2.558348e-02 232.35 -2.00 3.47 -2.00 318.87 0.00e+00 1.159122e-03 1.302179e-04 3.458230e-04 -6.000000e+00 1.145892e-03 290.45 -2.00 20.00 -2.00 318.01 0.00e+00 3.071 0.000 302.00 328.00 3 2.6112e+00 1.5645e-03 3.7874e-02 -6.0000e+00 6.4122e-02 6.7736e-03 1.8074e-03 2.2296e-02 -6.0000e+00 6.9258e-02 -1.9932e-02 1.2752e-03 1.0858e-02 -6.0000e+00 4.1305e-02 3.1178e-03 6.7111e-04 3.1338e-03 -6.0000e+00 1.7540e-02 1.1010e-03 1.4789e-05 3.0759e-05 3.1758e-05 -6.0000e+00 1.1772e-03 2.8377e-02 1.3490e-04 11 1 0 11 12 0 99.97 26.90 0.37 0.02838 0.02849 109 26 1 5 0 444.180 31.30 25.00 26.90 30.11 3.1 1025.26 -16392 -15538 -11082 -14261 -12790 -24283 -7461 -7732 -13469 -10356 -15330 -11153 -10975 -4031 -1846 -1903 -2429 -137 1558 3704 -2437 -992 1069 -588 -1051 -2055 399 -2191 -2714 -2545 113 -1174 1804 -3139 -2492 -2282 -4157 -1095 -345 648 -491 64 -1520 402 588 733 109 878 -319 -384 719 1501 1704 1772 523 995 315 -75 584 207 1328 1588 1732 1563 352 247 -49 92 698 1053 277 390 12 330 -361 -701 -731 -947 -1203 -969 -1125 -1386 -1998 -1531 -556 -457 93 203 392 914 411 558 -53 498 303 155 227 541 -180 -421 -501 -881 -640 -14 -1022 -1114 -640 -586 132 453 268 333 384 264 280 280 360 247 49 -139 -435 174 232 179 472 -30 331 1061 278 161 -12 -114 -132 158 -13 -144 47 -22 -22 -26 -107 -380 -287 -494 -540 -394 -512 -411 -827 -226 -267 -562 -453 -722 -529 -603 -251 -124 -148 -209 -12 147 361 -261 -105 113 -68 -132 -275 53 -288 -341 -320 15 -183 307 -600 -457 -403 -801 -240 -85 188 -162 23 -566 150 221 278 42 333 -123 -142 282 641 787 875 275 502 165 -39 300 113 730 877 1060 1052 233 167 -31 58 468 754 222 310 10 269 -275 -484 -488 -610 -824 -713 -898 -1248 -1858 -1496 -574 -479 102 232 449 1010 451 561 -49 483 298 172 271 686 -237 -560 -659 -1057 -747 -17 -1242 -1443 -866 -795 190 675 413 533 605 412 407 401 512 367 74 -224 -683 279 359 267 703 -44 449 1443 414 252 -19 -192 -229 276 -23 -271 90 -43 -42 -50 -198 -699 -511 SS 20230725T115303.6Z 8606.495180 96 1 45.59 2 70.38 80.18 147.30 35.54 0.00 1 0.00 1 0 17 4.892e-02 5.906e-03 1.874e-02 1.927e-03 4.096040e-01 9.881801e-04 4.710249e-03 -6.000000e+00 2.837698e-02 232.35 -2.00 3.47 -2.00 318.94 0.00e+00 9.756825e-04 2.328223e-04 2.767007e-04 -6.000000e+00 1.270948e-03 290.45 -2.00 20.00 -2.00 318.09 0.00e+00 2.944 0.000 302.00 328.00 3 3.6573e+00 2.7584e-03 3.6302e-02 -6.0000e+00 7.1123e-02 1.1003e-02 3.1935e-03 2.1364e-02 -6.0000e+00 7.6806e-02 -3.6327e-03 2.2636e-03 1.0407e-02 -6.0000e+00 4.5808e-02 -4.7241e-03 1.1899e-03 3.0247e-03 -6.0000e+00 1.9462e-02 4.4275e-04 3.8455e-04 5.4615e-05 3.0567e-05 -6.0000e+00 1.3050e-03 2.7188e-02 2.2387e-04 12 1 1 12 5 1 99.98 26.92 0.43 0.02719 0.03008 54 14 1 5 0 825.970 31.30 25.00 26.92 30.23 3.1 1025.92 -2932 -28941 2901 -22170 -7098 -19978 10315 13512 -12238 2348 -22798 -4001 -3050 6896 5959 -5125 -276 -448 -245 11091 -2814 -548 1274 825 842 -1857 1502 -1999 -312 -5686 4502 -6194 946 -2548 -4103 922 -4831 -459 -2819 1496 -1679 -478 -1422 -46 1064 -120 328 2372 -1644 538 -427 2778 1566 1655 921 -139 273 -689 909 451 1222 1842 1617 1583 -429 -1 327 -297 1101 876 -68 26 -254 210 56 -563 -1113 -661 -1028 -962 -1070 -1222 -1913 -1524 11 -497 245 220 458 892 423 512 -15 680 668 248 547 779 -83 -474 -348 -926 -505 -301 -969 -749 -866 -615 237 353 268 279 150 386 368 385 -12 77 -52 -200 -499 265 508 83 354 4 -33 831 47 143 52 -110 -389 362 108 -167 195 -259 190 -205 112 -362 -196 -78 -1135 90 -854 -218 -655 268 384 -502 91 -1138 -175 -151 373 385 -420 -24 -41 -24 1012 -303 -58 135 93 102 -245 195 -259 -38 -729 570 -973 155 -459 -727 151 -888 -94 -703 421 -538 -161 -501 -16 378 -43 119 838 -605 199 -168 1156 703 786 459 -72 144 -367 472 232 637 1017 970 1023 -289 0 202 -182 705 622 -53 21 -207 166 42 -392 -720 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