File name: Pandora32s1_GreenbeltMD_20240530_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240531T050938.6Z 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_20240530_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: 20240530 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 20240530T145314.2Z 8916.620304 275 1 48.87 2 32.88 111.62 71.85 237.03 0.00 1 0.00 1 0 17 7.582e-03 5.484e-03 1.890e-03 1.119e-03 2.011881e-01 5.782541e-04 2.402359e-03 -6.000000e+00 4.399842e-03 232.02 -2.00 3.47 -2.00 315.54 0.00e+00 3.132298e-04 5.511030e-05 2.652116e-05 -6.000000e+00 1.933978e-04 285.95 -2.00 20.00 -2.00 314.84 0.00e+00 1.190 0.000 302.00 328.00 3 4.9006e+00 1.5030e-03 1.5868e-02 -6.0000e+00 1.1036e-02 -7.5818e-03 1.6677e-03 1.0360e-02 -6.0000e+00 1.1922e-02 -5.4519e-04 9.5454e-04 5.0410e-03 -6.0000e+00 7.0929e-03 -2.9731e-03 4.2960e-04 1.3977e-03 -6.0000e+00 3.0095e-03 9.6144e-04 -2.8438e-05 3.1336e-05 1.7136e-05 -6.0000e+00 2.0212e-04 8.3265e-03 2.9236e-05 10 0 0 10 0 0 94.05 22.53 0.28 0.00833 0.00811 32 8 1 5 0 1527.130 26.83 20.00 22.53 27.20 4.6 1024.09 628 -1093 -685 -1733 -2872 -2156 -301 133 535 -740 -1378 -1230 629 286 484 347 -72 1027 500 1312 670 604 1025 690 701 502 307 -356 -108 -378 633 1368 1466 -585 -2195 -1438 -1703 -606 -72 -699 -1027 -587 -729 -558 -381 -339 -258 -507 -768 -259 654 838 549 845 692 880 518 148 567 735 1058 1382 1359 1078 164 -499 -163 -101 494 787 -286 194 -6 94 103 19 -284 -586 -597 -462 -1265 -1057 -1545 -1428 -813 -648 -342 -24 -9 318 133 705 -18 634 668 441 471 654 313 -328 -304 -697 -374 40 -580 -1114 -556 -461 -114 293 135 203 252 168 106 521 165 410 53 41 -376 -30 396 55 376 497 232 932 389 243 158 -100 -72 152 -36 20 -181 -76 10 -192 -42 -385 -497 155 -300 -193 -476 -724 -502 -70 34 148 -219 -408 -359 191 96 178 138 -30 428 214 572 301 270 457 317 335 248 152 -172 -49 -166 279 629 712 -297 -1090 -682 -837 -326 -44 -476 -750 -443 -561 -433 -295 -262 -197 -379 -564 -188 479 640 436 691 578 743 444 127 481 618 900 1218 1258 1042 161 -471 -145 -86 429 733 -286 200 -7 96 102 18 -248 -488 -498 -410 -1214 -1076 -1648 -1564 -919 -764 -418 -30 -11 393 158 794 -19 648 692 482 546 801 401 -423 -380 -833 -429 47 -705 -1414 -722 -613 -155 410 195 296 361 232 140 654 204 517 69 56 -530 -42 548 75 496 637 288 1141 491 319 214 -137 -99 213 -52 30 -277 -118 16 -298 -64 -576 -733 SS 20240530T150033.9Z 8916.625392 278 1 49.01 2 31.56 113.64 73.00 238.42 0.00 1 0.00 1 0 17 7.969e-03 5.585e-03 1.850e-03 1.119e-03 1.977993e-01 5.787064e-04 2.363574e-03 -6.000000e+00 4.623856e-03 232.02 -2.00 3.47 -2.00 315.46 0.00e+00 1.938632e-04 5.435765e-05 3.503644e-05 -6.000000e+00 2.032652e-04 285.95 -2.00 20.00 -2.00 314.78 0.00e+00 1.173 0.000 302.00 328.00 3 4.9294e+00 1.5027e-03 1.5620e-02 -6.0000e+00 1.1598e-02 -7.3742e-03 1.6674e-03 1.0182e-02 -6.0000e+00 1.2530e-02 -8.0996e-04 9.5245e-04 4.9564e-03 -6.0000e+00 7.4543e-03 -2.3749e-03 4.2699e-04 1.3616e-03 -6.0000e+00 3.1624e-03 9.5667e-04 -1.1304e-04 3.1249e-05 1.6931e-05 -6.0000e+00 2.1246e-04 8.6241e-03 4.9959e-06 10 0 0 10 0 0 83.71 22.56 0.35 0.00862 0.00777 31 7 1 5 0 1580.790 26.94 20.01 22.56 27.29 4.6 1024.60 473 -695 -1190 -1062 -3203 -1527 -166 1391 387 -380 -1679 -1472 326 -372 1069 -135 24 941 572 1398 595 204 1793 337 823 55 760 -651 -78 -43 1102 911 1806 -608 -2760 -1535 -1797 -844 -246 -464 -727 -860 -920 -716 -442 -89 -858 -324 -513 -371 381 637 928 814 811 924 1045 411 623 708 1164 1161 1135 1127 260 -414 88 -275 593 781 -53 -7 -300 214 -4 -321 -327 -473 -495 -517 -1162 -1020 -1595 -1510 -729 -574 -353 15 93 308 169 491 159 733 629 321 357 513 265 -226 -422 -593 -590 -2 -514 -998 -534 -481 -120 257 164 178 -56 248 253 512 369 245 272 68 -292 36 305 168 388 474 213 951 389 331 246 -259 -72 5 -117 -34 -60 -72 -74 -125 -78 -277 -574 119 -197 -350 -299 -817 -378 -41 348 110 -116 -515 -442 103 -133 396 -56 10 408 257 642 264 90 835 154 396 28 383 -316 -37 -20 498 440 865 -312 -1374 -762 -873 -466 -152 -318 -522 -651 -715 -562 -344 -69 -657 -238 -386 -274 287 481 739 680 698 766 882 350 520 615 970 1025 1085 1091 257 -384 77 -242 503 743 -53 -7 -309 225 -4 -306 -294 -391 -411 -448 -1140 -1047 -1683 -1666 -809 -683 -427 19 117 380 203 563 173 743 654 347 407 616 343 -295 -522 -706 -690 -2 -630 -1257 -700 -629 -163 352 237 261 -80 343 333 651 459 315 358 93 -416 51 422 224 511 594 264 1144 493 429 336 -348 -98 7 -167 -50 -89 -110 -115 -190 -120 -411 -832 SS 20240530T151308.3Z 8916.634124 284 1 49.29 2 29.36 117.41 75.00 240.73 0.00 1 0.00 1 0 17 7.219e-03 5.357e-03 1.831e-03 1.124e-03 1.937070e-01 5.819792e-04 2.313698e-03 -6.000000e+00 4.188986e-03 232.02 -2.00 3.47 -2.00 315.39 0.00e+00 2.436293e-04 5.378780e-05 2.761004e-05 -6.000000e+00 1.841227e-04 285.95 -2.00 20.00 -2.00 314.71 0.00e+00 1.147 0.000 302.00 328.00 3 4.9739e+00 1.5105e-03 1.5281e-02 -6.0000e+00 1.0507e-02 -3.8480e-03 1.6745e-03 9.9649e-03 -6.0000e+00 1.1351e-02 -5.9995e-04 9.5802e-04 4.8509e-03 -6.0000e+00 6.7529e-03 -3.3574e-03 4.2879e-04 1.3389e-03 -6.0000e+00 2.8654e-03 9.4480e-04 -1.0459e-04 3.1478e-05 1.6642e-05 -6.0000e+00 1.9242e-04 7.8999e-03 2.7220e-05 10 0 0 10 0 0 73.56 22.60 0.28 0.00790 0.00711 31 7 1 5 0 1589.820 26.94 20.00 22.60 27.63 4.7 1027.11 368 -1775 -331 -2214 -1273 -1625 -266 434 473 251 -1480 -86 137 -331 1203 355 -118 583 901 1174 537 649 1402 1150 363 242 280 -536 -206 -370 987 650 1602 -312 -2126 -1275 -2089 -874 -404 -355 -862 -789 -631 -630 -381 -544 -535 -182 -1109 -258 508 702 349 767 682 581 864 74 545 636 1084 1351 1185 1389 233 -300 -180 -217 615 513 120 29 10 139 26 -70 -417 -273 -433 -489 -953 -1135 -1472 -1465 -327 -630 -377 -58 -93 439 117 649 116 318 938 147 446 565 334 -345 -346 -670 -362 214 -645 -806 -634 -551 -92 228 158 94 142 268 293 340 246 223 282 -18 -422 -214 303 141 430 419 250 958 414 194 -132 -95 -144 192 176 -166 -21 37 -63 -95 -67 -293 -563 97 -521 -99 -648 -337 -400 -66 116 139 78 -463 -26 44 -117 462 147 -51 253 401 533 250 301 646 546 180 124 144 -268 -97 -168 447 309 797 -162 -1084 -619 -1053 -482 -251 -246 -641 -608 -494 -498 -300 -428 -417 -138 -829 -190 378 544 281 634 576 496 747 64 468 541 933 1203 1108 1352 230 -285 -161 -187 536 480 120 30 10 143 26 -66 -367 -228 -363 -436 -914 -1157 -1570 -1604 -369 -743 -461 -73 -117 543 139 732 123 325 969 161 516 691 427 -444 -432 -798 -415 247 -781 -1019 -822 -731 -124 318 226 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