File name: Pandora257s1_AustinTX_20241224_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20241225T063451.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20241224_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20241224 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 20241224T184513.2Z 9124.781402 420 1 22.30 2 53.73 184.05 84.82 253.73 0.00 1 0.00 1 0 17 1.533e-02 8.030e-03 5.222e-03 2.361e-03 2.261932e-01 1.281688e-03 2.527013e-03 -6.000000e+00 9.618911e-03 224.17 -2.00 3.25 -2.00 316.44 0.00e+00 6.559083e-05 1.590487e-04 4.697609e-05 -6.000000e+00 4.443031e-04 284.40 -2.00 20.00 -2.00 315.72 0.00e+00 1.686 0.000 302.00 328.00 3 5.4015e+00 3.3136e-03 1.9522e-02 -6.0000e+00 2.3640e-02 7.1847e-03 3.7112e-03 1.0569e-02 -6.0000e+00 2.5630e-02 1.8341e-02 2.1480e-03 5.2287e-03 -6.0000e+00 1.5336e-02 -1.1919e-02 9.7985e-04 1.4795e-03 -6.0000e+00 6.3925e-03 3.5427e-04 4.6770e-04 8.3860e-05 2.3620e-05 -6.0000e+00 5.5312e-04 2.0993e-02 -2.4823e-05 12 9 1 12 33 1 99.99 27.91 0.21 0.02099 0.02451 13 3 1 5 0 1592.450 36.00 20.01 27.91 30.22 0.0 965.15 -3427 -4602 -3058 2993 -5331 -3666 -826 -608 1110 -1576 -1307 -1254 1129 4264 3321 -2774 -320 1700 956 3146 3492 -1653 2812 2106 679 -931 -1940 594 -1628 543 2997 689 -1341 1162 -4696 3281 -4075 -1518 -1044 -472 447 21 -1495 -943 -779 -1131 -1833 1262 -400 259 984 529 694 1693 -105 217 760 639 409 673 1240 1800 2438 1253 -1427 -605 475 -390 201 656 771 748 -240 411 159 298 -157 -1818 -830 -616 -1715 -1412 -2241 -1405 -547 -352 -265 1 692 438 284 -477 160 -15 629 1403 687 453 202 -238 -292 -1108 -416 -12 88 -1100 -841 -553 -147 701 881 732 136 297 -605 -285 -84 -82 -49 3 -215 -467 388 726 -190 435 512 525 987 -115 -57 -211 256 123 -212 242 -224 263 651 82 -482 -710 -626 -596 -851 -554 488 -897 -600 -138 -110 211 -321 -274 -278 268 1095 862 -822 -97 525 307 1013 1139 -575 961 754 256 -361 -748 214 -579 188 1046 259 -536 457 -1944 1286 -1881 -784 -569 -288 293 14 -994 -629 -517 -747 -1295 846 -270 175 689 362 499 1256 -82 172 603 507 324 536 1017 1553 2213 1103 -1273 -548 406 -334 179 588 741 745 -242 396 144 266 -130 -1481 -693 -558 -1610 -1442 -2472 -1523 -625 -427 -315 1 833 544 330 -516 172 -16 681 1522 823 551 256 -302 -377 -1361 -491 -14 111 -1392 -1116 -768 -214 996 1295 1083 196 428 -817 -365 -106 -106 -68 4 -301 -654 561 1005 -253 586 665 682 1329 -155 -81 -307 381 178 -324 385 -369 415 1030 136 -780 -1120 -974 SS 20241224T185414.6Z 9124.787669 423 1 54.68 2 53.91 186.61 86.66 254.86 0.00 1 0.00 1 0 17 8.255e-03 5.902e-03 5.381e-04 3.157e-04 2.282941e-01 1.729149e-04 2.568535e-03 -6.000000e+00 5.179300e-03 224.17 -2.00 3.25 -2.00 315.65 0.00e+00 3.303169e-04 1.809251e-05 3.852286e-05 -6.000000e+00 2.391974e-04 284.40 -2.00 20.00 -2.00 314.98 0.00e+00 1.693 0.000 302.00 328.00 3 2.6026e+00 4.4219e-04 1.9625e-02 -6.0000e+00 1.2729e-02 -1.4814e-03 4.9352e-04 1.0647e-02 -6.0000e+00 1.3800e-02 3.6238e-03 2.8184e-04 5.2647e-03 -6.0000e+00 8.2573e-03 -4.1786e-03 1.2376e-04 1.5019e-03 -6.0000e+00 3.4424e-03 5.8011e-03 2.6001e-04 1.1132e-05 2.4952e-05 -6.0000e+00 2.9779e-04 2.0846e-02 5.4507e-06 10 0 0 10 0 0 100.00 27.92 0.32 0.02085 0.02280 863 83 1 5 0 63.350 36.00 20.00 27.92 30.61 0.0 967.37 -766 -1835 -1903 -3032 -3006 -1283 -89 388 147 -1110 -1903 -706 23 371 629 -51 -234 721 935 1055 1091 441 1088 1292 736 369 -84 -292 111 1203 1250 787 826 -756 -2534 -1072 -860 -466 -202 -511 -1032 -829 -593 -711 -459 -190 -596 -237 -204 176 992 1000 627 956 523 639 830 443 432 743 1019 1397 1274 1172 81 -612 -116 -58 622 894 165 -16 -120 81 -12 -342 -314 -607 -290 -380 -1176 -1398 -1936 -1703 -958 -719 -375 -145 135 256 25 240 69 335 794 580 280 495 204 -481 -452 -484 -631 12 -81 -881 -729 -389 -220 338 414 233 103 96 -75 147 389 296 345 288 -100 -112 368 309 432 655 324 748 1047 382 198 -82 -292 -83 86 11 -224 131 112 -417 -408 -389 -650 -194 -454 -509 -783 -736 -305 -22 102 39 -306 -546 -212 8 125 233 -20 -92 292 390 450 473 195 489 602 335 171 -38 -137 50 534 573 382 391 -367 -1244 -531 -464 -270 -128 -346 -723 -609 -446 -540 -348 -142 -439 -171 -145 126 733 780 491 779 440 523 684 366 356 615 871 1260 1165 1109 76 -555 -104 -52 552 859 164 -16 -120 80 -12 -308 -273 -512 -252 -344 -1135 -1418 -2034 -1896 -1085 -832 -454 -180 166 303 28 265 74 350 857 653 334 615 255 -604 -561 -588 -743 14 -98 -1099 -954 -514 -295 474 584 331 147 133 -100 186 502 381 454 399 -138 -154 512 414 569 852 408 939 1363 510 268 -114 -408 -120 126 16 -344 205 177 -649 -617 -590 -975 SS 20241224T190306.2Z 9124.793822 426 1 48.67 2 54.17 189.10 88.48 255.94 0.00 1 0.00 1 0 17 1.225e-02 6.561e-03 2.166e-03 1.068e-03 2.289906e-01 5.821635e-04 2.558698e-03 -6.000000e+00 7.689546e-03 224.17 -2.00 3.25 -2.00 316.20 0.00e+00 1.502585e-04 6.846431e-05 4.854632e-05 -6.000000e+00 3.550431e-04 284.40 -2.00 20.00 -2.00 315.49 0.00e+00 1.704 0.000 302.00 328.00 3 4.7313e+00 1.5004e-03 1.9729e-02 -6.0000e+00 1.8899e-02 1.3316e-02 1.6776e-03 1.0674e-02 -6.0000e+00 2.0487e-02 9.2468e-03 9.6375e-04 5.2812e-03 -6.0000e+00 1.2259e-02 -7.3239e-03 4.3401e-04 1.4989e-03 -6.0000e+00 5.1116e-03 6.7732e-04 5.1485e-04 3.7857e-05 2.4013e-05 -6.0000e+00 4.4204e-04 2.0316e-02 4.0555e-05 12 9 1 12 1 1 100.00 27.95 0.27 0.02032 0.02418 127 14 1 5 0 380.200 36.00 20.00 27.95 30.80 0.0 968.97 -1427 -2297 -2485 -2363 -7918 -3036 -1337 -1949 658 -1353 -574 -1794 -256 2418 2172 -1095 -812 1021 2030 1854 1564 -240 2319 1573 894 -641 -672 -160 -569 893 1061 841 -13 -802 -3597 1511 -1509 -911 -548 -457 -698 -487 227 -1141 -795 -965 -1070 431 -182 258 917 1418 862 1557 285 513 818 419 114 526 816 1429 1754 993 -481 -638 121 -79 381 1087 213 292 -191 160 202 -130 -50 -1363 -226 -535 -1405 -1592 -2163 -1597 -686 -644 -566 -122 456 530 -134 183 -46 367 581 963 322 638 72 -526 -451 -641 -507 -221 81 -909 -673 -268 -41 684 419 57 214 100 -90 78 403 -15 118 207 -54 -327 382 586 189 590 304 671 973 229 60 -98 -127 -92 70 14 -249 222 241 -220 -350 -452 -684 -276 -427 -508 -461 -1549 -558 -253 -402 142 -310 -134 -409 -63 647 642 -360 -279 358 726 681 585 -93 895 636 346 -255 -263 -65 -225 346 424 355 -5 -331 -1517 677 -697 -479 -307 -288 -479 -325 155 -794 -550 -662 -721 302 -127 181 665 1002 644 1205 230 421 676 347 95 437 699 1202 1556 917 -446 -564 101 -66 330 1015 202 288 -189 153 192 -114 -43 -1153 -195 -472 -1378 -1600 -2343 -1719 -778 -776 -675 -149 551 653 -156 208 -48 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