File name: Pandora32s1_GreenbeltMD_20240208_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T215209.9Z 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_20240208_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: 20240208 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 20240208T183142.8Z 8804.772024 284 1 48.27 2 56.41 200.47 71.40 211.90 0.00 1 0.00 1 0 17 1.038e-02 5.454e-03 3.078e-03 1.304e-03 2.635744e-01 6.530098e-04 3.164012e-03 -6.000000e+00 5.864884e-03 224.74 -2.00 3.47 -2.00 316.53 0.00e+00 4.921684e-04 7.705584e-05 4.840390e-05 -6.000000e+00 2.544077e-04 276.36 -2.00 20.00 -2.00 315.95 0.00e+00 1.802 0.000 302.00 328.00 3 4.5295e+00 1.6924e-03 2.2150e-02 -6.0000e+00 1.4507e-02 2.5650e-02 1.8962e-03 1.3169e-02 -6.0000e+00 1.5779e-02 -9.9254e-03 1.1137e-03 6.5514e-03 -6.0000e+00 9.3885e-03 1.8891e-05 5.3458e-04 1.9123e-03 -6.0000e+00 4.0112e-03 6.9206e-04 1.8462e-04 3.6582e-05 2.1780e-05 -6.0000e+00 2.7613e-04 4.4112e-03 5.2098e-05 10 0 0 10 0 0 99.82 21.67 0.20 0.00441 0.00580 28 7 1 5 0 1723.800 26.21 19.99 21.67 19.04 3.8 964.16 -719 -1423 -2456 -2124 -5243 -4354 -769 -453 685 -2280 -1836 -3403 -328 304 3 107 -433 715 1384 1698 1641 493 2469 -413 1071 -68 -22 -454 -948 -690 1030 826 1170 -524 -2098 -1736 -1773 -985 -100 396 -664 -163 -845 -359 243 237 58 -377 -172 -364 316 604 395 1294 487 947 577 -90 616 702 1396 1039 1293 1076 221 -308 -196 151 53 774 67 214 -90 29 -15 -335 -563 -623 -673 -834 -1195 -1036 -1891 -1595 -875 -567 -232 -312 214 173 402 634 -3 263 539 462 466 695 474 -361 -97 -782 -387 -190 -610 -932 -468 -367 -186 499 266 251 254 150 351 330 62 141 161 175 -394 184 386 -59 375 267 227 986 386 262 177 -197 -301 257 -2 -204 -130 16 1 -73 -75 -307 -555 -107 -238 -431 -361 -835 -636 -111 -71 119 -435 -350 -657 -67 69 1 30 -129 217 434 546 541 164 809 -143 386 -26 -8 -168 -332 -234 354 303 459 -218 -854 -674 -714 -438 -51 226 -413 -106 -561 -240 162 158 38 -246 -111 -234 207 416 284 959 373 733 455 -71 481 541 1086 842 1107 969 203 -274 -165 122 44 691 64 212 -90 29 -15 -300 -471 -499 -542 -722 -1122 -1039 -2000 -1732 -983 -663 -281 -387 266 213 474 708 -3 269 562 510 549 868 621 -479 -125 -957 -453 -224 -751 -1198 -616 -496 -258 714 395 379 379 216 480 434 81 186 221 251 -577 268 554 -83 513 356 293 1254 509 361 253 -287 -442 384 -4 -325 -212 26 2 -119 -122 -484 -863 SS 20240208T184155.3Z 8804.779112 287 1 17.60 2 57.14 203.28 72.42 214.01 0.00 1 0.00 1 0 17 1.392e-02 6.207e-03 6.230e-03 2.554e-03 2.687542e-01 1.276409e-03 3.237828e-03 -6.000000e+00 7.860874e-03 224.74 -2.00 3.47 -2.00 316.62 0.00e+00 5.286153e-04 1.538715e-04 6.570649e-05 -6.000000e+00 3.411583e-04 276.36 -2.00 20.00 -2.00 316.03 0.00e+00 1.837 0.000 302.00 328.00 3 4.6747e+00 3.3105e-03 2.2602e-02 -6.0000e+00 1.9444e-02 3.2383e-02 3.7119e-03 1.3456e-02 -6.0000e+00 2.1153e-02 -1.0631e-02 2.1880e-03 6.6988e-03 -6.0000e+00 1.2585e-02 2.1544e-04 1.0559e-03 1.9461e-03 -6.0000e+00 5.3747e-03 5.7158e-04 -3.2171e-04 7.1357e-05 2.2238e-05 -6.0000e+00 3.7038e-04 5.6879e-03 -3.6524e-05 12 1 1 12 1 1 85.23 21.67 0.42 0.00569 0.00327 7 5 1 5 0 2199.830 26.21 19.99 21.67 19.41 3.8 965.96 -4358 -2077 -1636 -2844 -2372 -6963 3733 -5296 1680 -2697 -4431 -2904 542 1474 377 627 -451 496 2261 2155 1998 -453 2131 -101 1260 1094 493 439 -1222 -1159 267 350 3464 -731 -1877 -2365 -1739 -687 -441 64 -874 -518 -1232 -72 -340 -235 -362 -578 -835 111 230 1166 627 1716 535 970 919 -306 566 342 1399 865 1326 1195 130 0 -577 211 247 858 -13 -172 151 52 737 -560 -100 -469 -965 -88 -1872 -781 -1654 -1494 -761 -982 6 4 167 181 361 772 -227 640 309 291 156 507 782 -596 -426 -964 -706 8 -1018 -740 -773 -206 -64 294 593 197 391 238 1 236 457 321 141 85 -317 46 440 366 218 124 195 1096 401 -92 419 236 -466 80 -207 -143 58 29 -55 21 -235 -90 -778 -639 -333 -272 -465 -351 -994 493 -836 278 -495 -828 -536 105 321 93 171 -131 147 683 671 639 -148 680 -34 442 399 182 157 -418 -385 90 126 1309 -298 -748 -906 -687 -300 -221 36 -538 -331 -810 -48 -225 -156 -238 -374 -534 70 150 792 447 1259 407 744 717 -241 439 263 1080 697 1129 1069 119 0 -483 171 205 765 -13 -171 151 51 695 -501 -83 -373 -777 -75 -1764 -781 -1745 -1621 -854 -1152 7 5 208 222 426 862 -240 652 322 322 184 636 1026 -793 -549 -1182 -828 9 -1259 -952 -1020 -279 -88 423 881 298 585 344 1 310 593 425 194 122 -466 68 633 517 299 165 252 1396 530 -128 600 345 -689 120 -321 -230 94 48 -92 35 -381 -142 -1213 SS 20240208T185052.8Z 8804.785334 290 1 48.85 2 57.86 205.70 73.36 215.82 0.00 1 0.00 1 0 17 9.553e-03 5.368e-03 2.642e-03 1.075e-03 2.728251e-01 5.379504e-04 3.281021e-03 -6.000000e+00 5.393758e-03 224.74 -2.00 3.47 -2.00 316.63 0.00e+00 4.471268e-04 6.496543e-05 4.936982e-05 -6.000000e+00 2.340810e-04 276.36 -2.00 20.00 -2.00 316.04 0.00e+00 1.873 0.000 302.00 328.00 3 4.0768e+00 1.3955e-03 2.3005e-02 -6.0000e+00 1.3341e-02 3.2849e-02 1.5637e-03 1.3653e-02 -6.0000e+00 1.4514e-02 -9.5656e-03 9.2318e-04 6.7934e-03 -6.0000e+00 8.6354e-03 -5.5277e-04 4.4672e-04 1.9678e-03 -6.0000e+00 3.6879e-03 9.9696e-04 -3.1387e-04 3.0091e-05 2.2635e-05 -6.0000e+00 2.5412e-04 5.4167e-03 -3.8408e-05 10 0 0 10 0 0 87.55 21.66 0.35 0.00542 0.00306 46 11 1 5 0 1061.740 26.21 19.99 21.66 19.37 3.8 966.37 -10 -3801 -283 -2651 -3106 -3441 -1248 1006 -1730 -977 -2598 -1763 453 -627 1027 422 -217 1292 1124 1503 453 766 1599 636 846 32 690 -986 -792 -770 1175 1124 1209 -400 -2780 -1226 -1489 -415 83 -387 -492 -864 -634 -629 -343 -48 -450 -240 -780 -416 412 673 1170 989 683 552 903 127 446 584 878 1106 1252 1304 449 -362 -329 -174 726 964 80 194 -218 162 110 -294 -422 -484 -616 -801 -1235 -1116 -1895 -1578 -821 -713 -189 57 69 485 272 622 197 494 663 340 262 684 340 -358 -315 -476 -472 129 -482 -1054 -467 -446 11 228 181 284 102 311 138 261 389 320 205 -156 -383 -72 143 163 280 448 113 922 392 145 139 -212 -165 93 26 -202 -65 194 63 -270 67 -307 -501 -2 -597 -45 -417 -479 -488 -176 155 -284 -171 -464 -312 86 -138 257 119 -60 368 334 461 145 243 503 211 299 12 259 -359 -268 -250 387 404 473 -168 -1148 -471 -600 -176 42 -219 -311 -545 -412 -415 -225 -32 -292 -152 -486 -257 262 459 846 711 511 423 705 100 343 442 673 898 1046 1174 418 -321 -282 -142 608 858 76 194 -221 159 101 -260 -355 -379 -490 -711 -1178 -1120 -1966 -1713 -938 -832 -233 70 85 608 319 699 212 503 698 375 307 844 456 -467 -406 -588 -542 148 -600 -1349 -621 -593 15 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