File name: Pandora32s1_GreenbeltMD_20240515_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240516T050702.5Z 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_20240515_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: 20240515 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 20240515T165423.6Z 8901.704440 340 1 48.67 2 20.00 173.52 88.95 71.14 0.00 1 0.00 1 0 17 7.773e-03 6.060e-03 1.652e-03 1.145e-03 1.669674e-01 5.940775e-04 1.979375e-03 -6.000000e+00 4.500455e-03 231.21 -2.00 3.47 -2.00 314.82 0.00e+00 2.937699e-04 4.910468e-05 2.100371e-05 -6.000000e+00 1.970620e-04 284.49 -2.00 20.00 -2.00 314.22 0.00e+00 1.064 0.000 302.00 328.00 3 5.0985e+00 1.5319e-03 1.3663e-02 -6.0000e+00 1.1272e-02 3.2060e-02 1.6946e-03 8.5048e-03 -6.0000e+00 1.2184e-02 -2.6110e-03 9.6925e-04 4.1402e-03 -6.0000e+00 7.2475e-03 -1.8049e-03 4.2620e-04 1.1535e-03 -6.0000e+00 3.0785e-03 9.4584e-04 2.2676e-04 3.1852e-05 1.4606e-05 -6.0000e+00 2.0711e-04 2.8512e-03 3.1246e-05 11 1 0 11 8 0 99.94 21.92 0.43 0.00285 0.00456 37 9 1 5 0 1315.360 26.41 20.00 21.92 22.47 4.5 998.38 300 -284 -402 -1423 -2390 -2210 -97 708 297 -351 -1748 -1037 -132 362 486 589 -162 434 1184 1158 1168 523 1068 780 560 218 25 -719 -499 43 1279 402 1848 -128 -2456 -1604 -1742 -823 -661 76 -724 -309 -352 -546 -265 -304 -656 -795 -593 -620 348 694 729 1101 473 879 993 4 730 527 1078 1162 1321 1306 297 -160 -558 -471 37 509 247 121 325 229 94 -72 -805 -1047 -1257 -1066 -1380 -1242 -1702 -1669 -534 -507 77 264 490 515 419 778 -308 -16 297 -14 261 677 582 1 -134 -805 -808 -200 -724 -909 -702 -339 11 460 290 287 236 442 106 -2 -39 184 124 21 -126 285 518 249 561 221 225 496 342 65 130 -258 -304 14 23 44 199 39 273 -209 -94 -432 -785 99 -102 -148 -509 -784 -669 -29 228 105 -132 -657 -380 -50 149 218 282 -80 216 600 598 616 275 559 419 312 126 14 -402 -262 22 640 210 1002 -72 -1364 -847 -948 -489 -444 56 -578 -254 -294 -460 -223 -254 -545 -643 -469 -481 272 563 612 948 417 780 891 3 650 466 961 1073 1279 1312 303 -157 -512 -415 33 485 252 128 345 240 96 -69 -721 -890 -1064 -957 -1333 -1272 -1825 -1834 -605 -600 94 330 616 639 500 879 -328 -17 305 -16 299 817 733 1 -165 -946 -915 -228 -867 -1137 -898 -444 15 631 410 408 331 592 134 -2 -47 225 158 28 -172 389 698 329 718 275 270 587 415 81 169 -339 -402 19 32 62 289 57 405 -309 -137 -618 -1107 SS 20240515T170610.4Z 8901.712620 350 1 48.56 2 19.90 181.68 86.86 72.93 0.00 1 0.00 1 0 17 7.210e-03 5.727e-03 5.384e-04 3.854e-04 1.630851e-01 2.005980e-04 1.951017e-03 -6.000000e+00 4.174391e-03 231.21 -2.00 3.47 -2.00 314.66 0.00e+00 3.372538e-04 1.606068e-05 1.672249e-05 -6.000000e+00 1.827807e-04 284.49 -2.00 20.00 -2.00 314.08 0.00e+00 1.063 0.000 302.00 328.00 3 2.9782e+00 5.1650e-04 1.3551e-02 -6.0000e+00 1.0455e-02 2.4509e-02 5.7057e-04 8.3573e-03 -6.0000e+00 1.1301e-02 -1.0711e-03 3.2673e-04 4.0711e-03 -6.0000e+00 6.7224e-03 -3.3236e-03 1.4307e-04 1.1403e-03 -6.0000e+00 2.8555e-03 7.9768e-03 1.6049e-04 1.0732e-05 1.4717e-05 -6.0000e+00 1.9210e-04 2.6370e-03 3.0020e-05 11 1 0 11 8 0 99.99 21.93 0.30 0.00264 0.00384 385 90 1 5 0 126.120 26.41 20.00 21.93 23.05 4.6 1001.93 437 -504 -345 -1394 -2217 -1148 -350 692 1067 -30 -1241 -788 49 -215 283 348 -17 586 896 909 1081 572 1245 881 599 379 -97 -574 -417 88 839 903 1293 -305 -2245 -1990 -1833 -1090 -250 -393 -776 -605 -590 -625 -267 -167 -543 -560 -642 -539 441 592 629 1053 654 883 884 343 540 513 931 1213 1400 1334 381 -253 -271 -457 308 641 79 194 133 225 93 -245 -539 -963 -967 -841 -1232 -1253 -1726 -1617 -715 -549 -87 163 276 502 340 469 -128 262 334 168 316 571 378 -120 -137 -637 -585 -55 -594 -916 -574 -431 -110 467 405 410 345 306 121 197 128 87 53 122 -205 120 226 144 405 339 50 665 322 111 77 -180 -182 62 24 -1 -1 196 43 -157 -55 -416 -601 152 -195 -137 -534 -756 -380 -115 230 396 -12 -496 -304 20 -90 132 177 -9 313 456 475 578 305 655 480 344 226 -58 -329 -219 47 440 499 706 -176 -1254 -1114 -993 -670 -171 -296 -613 -501 -501 -536 -227 -141 -450 -447 -520 -425 351 498 527 917 588 803 816 319 492 462 849 1104 1371 1318 384 -251 -255 -403 275 604 79 205 143 235 97 -233 -483 -839 -836 -750 -1169 -1309 -1844 -1801 -797 -658 -105 205 350 622 413 543 -134 268 346 179 352 699 474 -152 -165 -741 -671 -64 -711 -1123 -733 -572 -144 641 559 575 488 403 152 239 151 106 66 164 -276 162 297 191 508 424 59 797 384 141 99 -235 -239 84 32 -1 -2 285 63 -230 -77 -597 -839 SS 20240515T183317.1Z 8901.773115 409 1 5.86 2 27.74 230.63 70.86 85.93 0.00 1 0.00 1 0 17 7.327e-03 5.763e-03 9.975e-04 7.199e-04 1.750077e-01 3.749466e-04 2.095691e-03 -6.000000e+00 4.242378e-03 231.21 -2.00 3.47 -2.00 314.63 0.00e+00 3.337304e-04 3.000126e-05 1.608481e-05 -6.000000e+00 1.857723e-04 284.50 -2.00 20.00 -2.00 314.05 0.00e+00 1.129 0.000 302.00 328.00 3 2.0928e+00 9.6468e-04 1.4455e-02 -6.0000e+00 1.0625e-02 1.6324e-02 1.0659e-03 8.9649e-03 -6.0000e+00 1.1486e-02 -1.1960e-03 6.1075e-04 4.3669e-03 -6.0000e+00 6.8320e-03 -2.8414e-03 2.6686e-04 1.2231e-03 -6.0000e+00 2.9019e-03 1.7716e-02 3.4623e-05 1.9967e-05 1.5714e-05 -6.0000e+00 1.9524e-04 2.6203e-03 1.2646e-05 12 1 1 12 1 1 98.59 21.97 0.32 0.00262 0.00288 52 103 1 5 0 110.580 26.41 20.00 21.97 23.56 4.6 1004.32 77 -285 -375 -1680 -2637 -1114 -668 440 805 85 -1196 -953 272 -162 393 208 -54 699 1007 1119 1227 622 1112 888 627 302 -32 -409 -351 155 904 888 1317 -291 -2281 -1873 -1869 -1014 -423 -307 -711 -655 -509 -764 -290 -204 -511 -544 -545 -302 275 683 816 928 636 906 904 250 531 523 918 1225 1369 1335 368 -145 -412 -416 306 676 -9 142 57 220 323 -257 -552 -899 -957 -690 -1129 -1128 -1728 -1620 -742 -602 -78 179 149 420 303 448 81 350 524 206 240 597 266 -132 -196 -640 -640 -29 -552 -883 -562 -628 -115 430 196 340 264 317 182 309 213 295 133 67 -252 83 201 136 377 449 257 783 439 118 168 -181 -127 115 32 -139 -83 140 64 -160 -195 -402 -575 28 -107 -146 -634 -952 -359 -215 155 317 34 -474 -367 109 -73 186 108 -28 359 530 604 679 344 609 503 354 178 -19 -231 -193 80 495 484 762 -168 -1357 -1042 -1080 -627 -294 -227 -584 -539 -429 -654 -246 -172 -423 -455 -438 -236 219 574 689 818 553 799 810 226 471 457 813 1143 1320 1313 370 -143 -380 -376 281 634 -9 151 61 231 321 -244 -510 -763 -846 -636 -1075 -1136 -1877 -1766 -850 -714 -95 218 183 520 365 508 86 360 549 225 277 703 338 -164 -239 -746 -726 -33 -660 -1094 -699 -814 -154 585 271 478 360 415 233 378 254 362 169 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