File name: Pandora32s1_GreenbeltMD_20240215_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T215212.3Z 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_20240215_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: 20240215 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 20240215T184017.1Z 8811.777975 277 1 49.36 2 54.82 203.73 51.42 97.00 0.00 1 0.00 1 0 17 9.606e-03 5.542e-03 3.030e-03 1.238e-03 2.731617e-01 6.200362e-04 3.274413e-03 -6.000000e+00 5.431264e-03 225.00 -2.00 3.47 -2.00 316.62 0.00e+00 6.230384e-04 7.457561e-05 4.889912e-05 -6.000000e+00 2.354542e-04 276.41 -2.00 20.00 -2.00 316.03 0.00e+00 1.731 0.000 302.00 328.00 3 4.5012e+00 1.6107e-03 2.1933e-02 -6.0000e+00 1.3442e-02 1.8663e-02 1.8046e-03 1.3654e-02 -6.0000e+00 1.4619e-02 -1.1627e-02 1.0627e-03 6.7880e-03 -6.0000e+00 8.6964e-03 9.9897e-04 5.1201e-04 1.9914e-03 -6.0000e+00 3.7134e-03 7.4864e-04 -1.3484e-04 3.4689e-05 2.2553e-05 -6.0000e+00 2.5553e-04 3.6197e-03 -1.4883e-05 10 0 0 10 0 0 99.11 21.18 0.42 0.00362 0.00261 32 8 1 5 0 1542.330 25.79 20.01 21.18 13.20 3.8 932.73 -1683 -1237 -1443 -2419 -4296 -4643 -94 -713 -82 -1549 -2378 -1349 -503 -610 -36 708 -518 479 993 1203 345 176 2241 1065 432 413 -351 -74 -752 182 1560 583 977 -146 -2440 -1365 -1473 -626 -205 -106 -1051 -498 -754 -289 390 -337 -209 -208 -524 -472 669 1096 978 1218 401 1021 686 118 300 197 983 1059 1469 1216 68 -228 -288 191 357 952 209 -187 -79 121 -179 -387 -528 -706 -772 -509 -1287 -1315 -1725 -1567 -766 -646 -55 -60 90 421 155 974 -124 804 823 510 446 460 223 -381 -328 -669 -400 211 -606 -1026 -446 -700 -63 259 -5 147 -40 147 339 514 457 257 162 -53 -407 309 356 167 299 480 333 914 398 287 -6 -171 -359 175 361 -173 -72 -126 -28 -160 -96 -326 -512 -240 -199 -244 -400 -646 -642 -13 -107 -14 -285 -443 -248 -100 -129 -9 191 -151 143 308 385 115 58 729 338 147 147 -127 -25 -264 61 531 202 368 -59 -964 -504 -568 -275 -100 -61 -640 -319 -501 -194 260 -226 -139 -135 -333 -298 434 761 679 890 307 793 546 95 236 152 766 824 1242 1112 61 -205 -237 158 288 860 200 -190 -77 120 -168 -349 -427 -565 -627 -432 -1178 -1340 -1805 -1718 -839 -760 -65 -74 112 507 185 1103 -129 828 876 567 525 573 287 -498 -426 -836 -463 244 -763 -1322 -598 -939 -87 368 -8 219 -61 210 463 683 593 345 221 -79 -595 447 523 236 404 644 424 1191 524 391 -8 -246 -524 262 571 -278 -120 -205 -47 -261 -156 -512 -813 SS 20240215T184908.9Z 8811.784131 280 1 48.18 2 55.55 206.21 49.74 98.50 0.00 1 0.00 1 0 17 1.002e-02 5.369e-03 2.753e-03 1.084e-03 2.782955e-01 5.434976e-04 3.346452e-03 -6.000000e+00 5.664258e-03 225.00 -2.00 3.47 -2.00 316.71 0.00e+00 3.993419e-04 6.670515e-05 5.140015e-05 -6.000000e+00 2.456207e-04 276.41 -2.00 20.00 -2.00 316.12 0.00e+00 1.762 0.000 302.00 328.00 3 4.1795e+00 1.4127e-03 2.2355e-02 -6.0000e+00 1.4018e-02 1.5520e-02 1.5837e-03 1.3931e-02 -6.0000e+00 1.5247e-02 -1.0638e-02 9.3605e-04 6.9377e-03 -6.0000e+00 9.0702e-03 1.0999e-03 4.5364e-04 2.0023e-03 -6.0000e+00 3.8721e-03 9.9501e-04 -4.1505e-04 3.0387e-05 2.2862e-05 -6.0000e+00 2.6661e-04 3.8085e-03 -8.1374e-05 10 0 0 10 0 0 79.62 21.19 0.25 0.00381 0.00069 46 11 1 5 0 1047.360 25.79 20.00 21.19 13.92 3.9 937.29 -24 -2034 -1603 -3973 -2545 -4915 -1831 -667 -615 -1463 -2934 -2578 576 282 1088 31 -312 672 711 1289 987 729 930 1038 831 378 461 -714 -705 -385 1802 481 1764 -601 -2213 -1535 -1473 -600 123 -165 -628 -927 -775 -557 -215 -142 -172 -428 -798 -243 757 888 863 1134 638 664 855 102 445 470 1224 1071 1259 1206 135 -352 -75 -19 513 1000 215 -35 -205 194 -278 -208 -203 -602 -576 -685 -1232 -1205 -1835 -1596 -833 -724 -194 -67 120 375 270 632 240 432 719 473 353 603 371 -291 -244 -553 -446 290 -492 -973 -619 -534 -79 214 162 49 120 168 162 419 399 363 114 -21 -369 -27 304 102 396 479 219 943 619 69 -30 -144 -131 14 171 -58 -227 105 -151 -195 22 -218 -511 -3 -308 -253 -623 -358 -655 -242 -96 -99 -254 -518 -454 107 59 258 8 -87 192 210 391 308 228 291 336 284 135 166 -251 -234 -124 586 169 661 -240 -867 -574 -570 -257 60 -92 -378 -584 -499 -362 -140 -92 -111 -272 -503 -152 484 597 607 826 479 506 660 80 341 357 936 853 1061 1067 123 -309 -62 -16 422 884 205 -35 -204 190 -263 -185 -168 -478 -462 -589 -1154 -1206 -1932 -1729 -934 -845 -234 -82 149 458 318 705 253 440 749 523 416 756 489 -387 -315 -678 -523 341 -607 -1253 -817 -724 -110 308 242 75 180 243 224 555 521 484 158 -31 -544 -40 440 144 545 641 285 1208 821 96 -44 -212 -195 22 267 -93 -372 174 -253 -324 36 -347 -801 SS 20240215T185518.5Z 8811.788408 284 1 48.17 2 56.09 207.90 48.57 99.58 0.00 1 0.00 1 0 17 1.087e-02 5.323e-03 4.446e-03 1.529e-03 2.826513e-01 7.649810e-04 3.382710e-03 -6.000000e+00 6.146966e-03 225.00 -2.00 3.47 -2.00 317.02 0.00e+00 4.007040e-04 1.016060e-04 5.912476e-05 -6.000000e+00 2.664163e-04 276.41 -2.00 20.00 -2.00 316.43 0.00e+00 1.787 0.000 302.00 328.00 3 4.7435e+00 1.9982e-03 2.2679e-02 -6.0000e+00 1.5213e-02 1.6816e-02 2.2437e-03 1.4147e-02 -6.0000e+00 1.6544e-02 -7.3645e-03 1.3460e-03 7.0475e-03 -6.0000e+00 9.8418e-03 -8.2501e-04 6.6391e-04 2.0460e-03 -6.0000e+00 4.2033e-03 5.4788e-04 1.1219e-04 4.3078e-05 2.2769e-05 -6.0000e+00 2.8912e-04 2.8854e-03 2.1492e-05 10 0 0 10 0 0 99.98 21.20 0.33 0.00289 0.00373 36 8 1 5 0 1338.000 25.79 20.00 21.20 14.20 3.8 937.78 -2190 -2608 -3059 -2513 -3493 -4723 -1799 549 -824 -1605 -2805 -877 -943 171 1933 719 -552 527 70 2104 901 -491 2898 672 1183 233 -332 -977 -321 -332 1572 1184 1175 -250 -2906 -1968 -2428 -994 -1102 -109 -597 -449 -557 -365 126 -214 -510 -1 -561 -662 843 1257 977 1174 618 945 919 -47 114 349 868 1064 1126 1206 480 -40 -240 -352 535 945 -171 298 31 145 -81 -682 -52 -792 -1250 -750 -1293 -931 -1645 -1286 -946 -607 -99 -235 225 443 354 835 88 427 685 470 331 804 373 -491 -162 -715 -327 92 -452 -943 -708 -440 -38 364 71 229 170 85 87 266 261 330 63 -23 -433 2 308 114 284 491 199 981 242 108 146 -73 -165 -128 195 -80 42 -10 82 -171 -150 -259 -449 -250 -336 -414 -330 -421 -532 -201 66 -113 -238 -424 -131 -153 31 396 165 -136 133 18 562 250 -138 792 195 361 75 -108 -309 -95 -96 460 374 401 -90 -1044 -670 -862 -391 -503 -56 -339 -266 -339 -224 77 -132 -313 -1 -334 -393 510 802 656 819 446 692 685 -35 85 255 641 819 922 1041 424 -34 -193 -276 428 818 -161 289 30 140 -75 -594 -42 -610 -976 -630 -1188 -918 -1715 -1381 -1055 -706 -120 -290 280 542 416 925 92 432 707 517 391 1011 494 -659 -210 -880 -384 108 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