File name: Pandora32s1_GreenbeltMD_20240412_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240413T051516.4Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240412_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: 20240412 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 20240412T142100.2Z 8868.597919 172 1 48.40 2 47.84 117.47 76.55 66.61 0.00 1 0.00 1 0 17 8.718e-03 5.632e-03 2.478e-03 1.050e-03 2.493704e-01 5.336888e-04 2.977996e-03 -6.000000e+00 4.999489e-03 228.61 -2.00 3.47 -2.00 316.49 0.00e+00 5.833151e-04 6.259171e-05 5.489513e-05 -6.000000e+00 2.177988e-04 280.98 -2.00 20.00 -2.00 315.82 0.00e+00 1.487 0.000 302.00 328.00 3 4.3339e+00 1.3946e-03 1.9595e-02 -6.0000e+00 1.2458e-02 6.1314e-03 1.5580e-03 1.2681e-02 -6.0000e+00 1.3501e-02 5.3460e-03 9.1082e-04 6.2397e-03 -6.0000e+00 8.0308e-03 -5.9718e-03 4.3385e-04 1.7939e-03 -6.0000e+00 3.4188e-03 1.1505e-03 1.2285e-04 2.9608e-05 2.0066e-05 -6.0000e+00 2.3213e-04 1.6255e-03 1.7120e-05 10 0 0 10 0 0 99.96 21.60 0.30 0.00163 0.00255 78 18 1 5 0 620.390 26.11 19.99 21.60 18.23 4.5 976.69 -940 -1181 -451 -1021 -3109 -3674 -1287 -601 -170 -520 -2055 -1917 -916 -234 422 327 -34 490 1147 1097 1146 173 1469 742 672 451 436 -421 -388 -96 1100 778 1089 -191 -2260 -1908 -2113 -1322 -548 -147 -752 -497 -560 -278 -217 -144 -395 -446 -442 -745 579 610 798 876 692 957 1018 223 176 148 862 1337 1680 1597 520 4 -413 -629 161 926 342 201 89 238 123 -334 -808 -1152 -1270 -874 -1394 -1208 -1649 -1569 -718 -781 9 353 460 631 415 624 -344 -60 262 226 331 676 378 -195 -145 -745 -644 -91 -727 -938 -633 -402 -84 435 557 504 268 253 110 52 -45 119 0 126 -250 42 268 147 482 172 41 572 374 235 143 -272 -120 -16 111 -58 7 185 101 -107 -8 -347 -685 -139 -198 -79 -173 -481 -523 -198 -93 -30 -98 -395 -365 -187 -54 112 90 -10 146 355 351 378 57 481 255 246 173 169 -157 -134 -32 369 283 430 -80 -933 -740 -857 -610 -280 -83 -474 -331 -385 -194 -151 -100 -271 -299 -289 -482 382 432 563 650 532 751 814 181 140 116 681 1114 1428 1461 492 4 -339 -521 136 824 322 201 90 234 120 -298 -689 -913 -1016 -772 -1317 -1194 -1765 -1666 -802 -937 11 441 579 775 503 688 -367 -60 270 254 391 838 507 -253 -187 -886 -750 -106 -874 -1211 -852 -536 -116 612 828 769 399 371 148 68 -58 156 1 181 -358 63 388 206 670 229 52 736 482 326 201 -394 -176 -25 169 -94 11 302 167 -174 -12 -550 -1055 SS 20240412T144421.1Z 8868.614133 187 1 8.43 2 43.93 123.37 72.46 69.63 0.00 1 0.00 1 0 17 8.484e-03 5.851e-03 9.482e-04 5.258e-04 2.375465e-01 2.687693e-04 2.851554e-03 -6.000000e+00 4.864160e-03 228.61 -2.00 3.47 -2.00 315.76 0.00e+00 3.498903e-04 2.668658e-05 4.688553e-05 -6.000000e+00 2.119443e-04 280.98 -2.00 20.00 -2.00 315.14 0.00e+00 1.387 0.000 302.00 328.00 3 1.4756e+00 6.9489e-04 1.8426e-02 -6.0000e+00 1.2121e-02 -2.0183e-04 7.7347e-04 1.2033e-02 -6.0000e+00 1.3136e-02 7.3691e-04 4.4512e-04 5.9202e-03 -6.0000e+00 7.8137e-03 -3.1254e-03 2.0396e-04 1.6658e-03 -6.0000e+00 3.3259e-03 2.2692e-02 -1.1819e-04 1.4663e-05 2.0153e-05 -6.0000e+00 2.2590e-04 1.9858e-03 -1.9399e-05 12 1 1 12 1 1 95.60 21.65 0.30 0.00199 0.00110 127 173 1 5 0 65.790 26.21 20.03 21.65 20.13 4.4 986.46 225 -614 -68 -2274 -3100 -2859 -2083 22 340 -443 -2016 -1360 -711 79 538 320 288 582 939 925 1122 719 1156 1170 628 368 73 -459 -356 -232 947 867 1100 -155 -2267 -2035 -2008 -1190 -441 -238 -722 -483 -366 -462 -96 -53 -358 -549 -632 -427 303 860 738 1034 844 892 898 227 463 396 874 1367 1505 1527 542 -105 -289 -425 175 703 211 106 146 220 81 -246 -672 -1108 -1127 -768 -1285 -1235 -1643 -1696 -970 -705 -41 209 306 455 334 395 -211 140 242 57 408 595 478 -105 -217 -694 -822 -106 -574 -950 -596 -518 -110 446 465 536 418 329 -10 218 -8 55 124 102 -171 148 298 315 424 462 102 802 384 195 225 -106 -218 2 34 -78 7 164 28 -116 -174 -422 -744 48 -148 -17 -562 -689 -627 -459 5 85 -119 -552 -366 -205 24 186 115 109 227 378 385 480 307 492 518 278 171 35 -207 -158 -98 406 401 515 -77 -1107 -934 -961 -609 -254 -154 -495 -349 -272 -349 -72 -39 -266 -396 -444 -311 215 649 564 828 702 757 742 190 378 334 746 1174 1340 1459 513 -98 -257 -358 151 649 209 107 149 227 79 -227 -584 -936 -957 -686 -1246 -1273 -1759 -1830 -1102 -827 -49 259 383 556 397 444 -225 146 258 64 467 727 609 -136 -275 -843 -968 -125 -705 -1210 -764 -692 -148 633 675 772 607 463 -13 279 -11 71 164 140 -246 212 414 438 559 600 130 995 484 256 312 -147 -307 3 51 -118 11 254 43 -181 -270 -629 -1113 SS 20240412T145301.6Z 8868.620157 190 1 0.51 2 42.54 125.75 70.92 70.74 0.00 1 0.00 1 0 17 9.132e-03 6.090e-03 3.310e-03 1.901e-03 2.326972e-01 9.739770e-04 2.799116e-03 -6.000000e+00 5.235044e-03 228.61 -2.00 3.47 -2.00 315.63 0.00e+00 4.015449e-04 9.444137e-05 4.680860e-05 -6.000000e+00 2.281286e-04 280.98 -2.00 20.00 -2.00 315.02 0.00e+00 1.356 0.000 302.00 328.00 3 1.1715e+00 2.5155e-03 1.8036e-02 -6.0000e+00 1.3045e-02 1.5479e-03 2.7984e-03 1.1796e-02 -6.0000e+00 1.4138e-02 2.4407e-03 1.6094e-03 5.8054e-03 -6.0000e+00 8.4098e-03 -3.8744e-03 7.3263e-04 1.6378e-03 -6.0000e+00 3.5791e-03 3.1927e-02 -3.2929e-04 5.2961e-05 2.0107e-05 -6.0000e+00 2.4315e-04 2.8941e-03 -1.5137e-05 12 1 1 12 1 1 41.87 21.68 0.29 0.00289 0.00042 9 227 1 5 0 50.190 26.21 19.97 21.68 20.87 4.5 991.37 464 417 -1021 -936 -4356 -2335 -744 -1673 815 -441 -1542 -2097 -834 1087 609 1160 293 607 757 922 1867 -108 1144 -2 718 191 64 -635 -742 -461 253 1437 996 241 -2560 -2635 -2202 -1401 -757 2 -665 161 -537 -411 426 -9 -392 -329 -407 -665 1109 527 540 1386 726 1391 877 156 542 -4 900 1107 1815 1457 378 -436 -285 -598 -112 229 37 401 359 189 123 -236 -368 -1400 -1183 -787 -1362 -1293 -1299 -1541 -1033 -733 -87 -11 393 303 249 396 -151 483 -294 236 395 658 523 -7 -75 -704 -1060 30 -711 -905 -692 -333 -11 681 571 527 592 166 70 6 161 9 27 237 -302 222 389 65 387 498 215 387 124 246 135 2 -274 -48 -30 49 -60 192 -64 -362 -56 -272 -516 109 110 -265 -234 -1083 -519 -165 -415 223 -121 -429 -580 -245 357 215 452 114 242 312 392 810 -47 497 -1 325 91 31 -294 -338 -199 111 670 475 122 -1276 -1238 -1072 -775 -447 1 -468 119 -411 -304 327 -7 -298 -243 -292 -472 797 407 423 1131 591 1147 741 133 453 -3 750 975 1651 1369 367 -418 -259 -515 -98 216 37 411 373 192 123 -223 -324 -1204 -1019 -714 -1290 -1305 -1412 -1694 -1154 -848 -106 -14 486 366 292 454 -164 508 -308 257 461 817 679 -9 -93 -839 -1225 34 -860 -1135 -905 -439 -15 953 820 776 848 231 92 8 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