File name: Pandora257s1_AustinTX_20241028_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20241029T061911.6Z 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_20241028_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: 20241028 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 20241028T145805.9Z 9067.623680 216 1 2.23 2 64.37 125.28 28.65 158.08 0.00 1 0.00 1 0 25 1.004e-02 6.111e-03 2.902e-03 1.495e-03 2.622094e-01 8.219870e-04 2.922201e-03 -6.000000e+00 6.330586e-03 225.96 -2.00 3.25 -2.00 316.15 0.00e+00 4.117457e-04 9.568234e-05 5.241258e-05 -6.000000e+00 2.960635e-04 288.75 -2.00 20.00 -2.00 315.36 0.00e+00 2.297 0.000 302.00 328.00 3 1.8578e+00 2.1220e-03 2.5502e-02 -6.0000e+00 1.5598e-02 9.2881e-04 2.3688e-03 1.2373e-02 -6.0000e+00 1.6883e-02 2.8514e-04 1.3560e-03 6.0508e-03 -6.0000e+00 1.0116e-02 -1.8946e-03 6.0704e-04 1.7119e-03 -6.0000e+00 4.2160e-03 6.5532e-03 -2.0268e-05 5.2871e-05 2.7455e-05 -6.0000e+00 3.6229e-04 2.7417e-02 -7.9466e-05 12 1 1 12 1 1 99.31 27.93 0.32 0.02742 0.02726 23 57 1 5 0 92.650 35.75 20.00 27.93 28.86 0.0 955.34 -2293 -2241 -1883 -4113 -3301 -618 -2613 -1489 -207 -2961 -3868 317 -828 282 608 -709 267 763 2014 980 537 485 639 1285 1062 377 -412 -132 -140 1503 1177 606 861 -448 -2005 -763 -517 -710 68 -97 -867 -454 -283 -527 -190 -115 -340 -130 -179 210 1214 1051 650 1067 410 760 1009 402 167 805 1020 1316 1453 1024 12 -939 -20 -170 745 900 -66 -310 -93 -58 -55 -54 -251 -492 -184 -511 -1231 -1548 -2232 -1503 -1176 -697 -440 -226 97 -22 153 174 260 386 664 691 426 332 128 -350 -681 -406 -807 39 -13 -841 -827 -215 -41 337 492 187 48 6 -15 282 543 333 273 267 -65 -89 482 331 381 802 519 623 1010 377 256 -32 -323 -114 124 -112 -388 110 228 -344 -278 -461 -820 -475 -452 -378 -876 -666 -121 -549 -336 -46 -703 -963 81 -221 84 200 -239 94 279 755 358 200 184 249 520 448 163 -176 -55 -56 595 489 269 376 -200 -909 -352 -247 -371 39 -60 -557 -306 -196 -369 -133 -80 -233 -87 -120 143 859 755 495 811 323 612 818 327 136 658 830 1134 1277 902 10 -831 -16 -143 658 831 -64 -300 -93 -55 -51 -48 -216 -414 -162 -474 -1183 -1576 -2376 -1636 -1317 -800 -528 -270 118 -26 173 188 273 412 715 783 501 412 161 -438 -843 -487 -970 46 -16 -1084 -1089 -288 -56 472 716 268 69 9 -19 368 701 446 376 376 -92 -129 675 460 518 1039 672 812 1332 515 358 -47 -472 -168 191 -177 -620 178 370 -552 -444 -718 -1264 SS 20241028T151447.8Z 9067.635276 231 1 20.06 2 61.48 128.49 27.63 166.54 0.00 1 0.00 1 0 17 8.192e-03 5.867e-03 5.453e-04 3.062e-04 2.396316e-01 1.684713e-04 2.670336e-03 -6.000000e+00 5.168380e-03 225.96 -2.00 3.25 -2.00 315.84 0.00e+00 4.041801e-04 1.847649e-05 4.915095e-05 -6.000000e+00 2.416259e-04 288.75 -2.00 20.00 -2.00 315.08 0.00e+00 2.084 0.000 302.00 328.00 3 1.1615e+00 4.3293e-04 2.3174e-02 -6.0000e+00 1.2735e-02 5.8319e-04 4.8303e-04 1.1288e-02 -6.0000e+00 1.3783e-02 1.7000e-04 2.7580e-04 5.5197e-03 -6.0000e+00 8.2580e-03 -3.2883e-03 1.2176e-04 1.5607e-03 -6.0000e+00 3.4428e-03 1.6707e-02 2.0094e-04 1.0865e-05 2.5387e-05 -6.0000e+00 2.9569e-04 2.6678e-02 -3.2941e-05 12 1 1 12 1 1 99.99 27.97 0.31 0.02668 0.02819 781 206 1 5 0 25.640 36.00 20.00 27.97 29.34 0.0 958.97 -946 -1986 -2119 -2897 -2563 -1155 -184 224 8 -1494 -1926 -806 27 303 399 48 -172 738 815 1299 973 586 1110 1143 515 351 -377 -309 -27 971 1105 674 715 -1070 -2471 -1224 -803 -469 -82 -530 -1038 -709 -425 -576 -392 -126 -469 -228 -173 231 966 905 741 975 431 732 921 525 520 844 1201 1404 1261 1098 46 -615 -126 14 738 859 112 8 -121 54 -98 -324 -381 -573 -250 -433 -1269 -1466 -1855 -1769 -950 -674 -351 -217 120 168 93 286 115 384 770 477 285 486 70 -472 -465 -501 -648 78 -119 -973 -704 -390 -155 367 407 193 99 50 1 217 387 313 390 344 -93 -54 314 319 436 661 304 808 1022 384 168 -91 -263 -86 139 -37 -261 118 65 -434 -306 -391 -661 -215 -479 -510 -671 -563 -269 -41 54 2 -409 -548 -224 8 103 139 18 -69 284 324 527 403 247 478 512 227 157 -167 -140 -12 419 496 302 334 -514 -1197 -602 -407 -258 -49 -344 -702 -502 -308 -422 -287 -91 -334 -160 -120 162 702 665 574 787 345 597 757 432 427 698 1027 1220 1118 1009 42 -541 -109 12 669 813 110 7 -119 53 -94 -297 -324 -494 -214 -391 -1230 -1499 -1973 -1932 -1061 -797 -421 -266 147 198 106 309 120 408 820 534 340 608 89 -596 -578 -609 -764 93 -146 -1233 -908 -527 -214 514 576 275 141 69 2 281 496 415 530 479 -130 -76 437 440 573 854 393 1044 1333 516 231 -130 -375 -127 209 -56 -405 185 103 -679 -477 -594 -1020 SS 20241028T152146.7Z 9067.640124 237 1 1.05 2 60.31 129.90 27.35 170.22 0.00 1 0.00 1 0 17 8.473e-03 6.145e-03 1.605e-03 9.788e-04 2.316947e-01 5.399160e-04 2.591698e-03 -6.000000e+00 5.345200e-03 225.96 -2.00 3.25 -2.00 315.57 0.00e+00 3.934098e-04 5.547516e-05 4.655910e-05 -6.000000e+00 2.499379e-04 288.75 -2.00 20.00 -2.00 314.83 0.00e+00 2.010 0.000 302.00 328.00 3 6.2502e-01 1.3831e-03 2.2366e-02 -6.0000e+00 1.3170e-02 -4.2160e-03 1.5404e-03 1.0912e-02 -6.0000e+00 1.4255e-02 -5.7887e-04 8.7890e-04 5.3367e-03 -6.0000e+00 8.5408e-03 -2.6291e-03 3.8377e-04 1.5053e-03 -6.0000e+00 3.5602e-03 3.1142e-02 2.7419e-05 3.4708e-05 2.4902e-05 -6.0000e+00 3.0586e-04 2.6810e-02 -6.4877e-05 12 1 1 12 1 1 64.54 28.00 0.31 0.02681 0.02702 43 221 1 5 0 23.850 36.00 19.99 28.00 29.66 0.0 961.67 -1031 -1558 -1871 -3830 -1775 -947 -179 304 97 -1682 -1788 -1281 -145 2 468 209 -186 892 386 1220 1317 587 1147 1129 509 232 -24 -169 -81 1341 1370 914 945 -1053 -2663 -1157 -1020 -93 30 -216 -864 -984 -527 -582 -366 -183 -613 -140 -260 264 876 1102 717 847 630 784 872 435 423 891 1340 1428 1232 1148 6 -414 -170 125 566 889 171 -129 -130 -4 -94 -431 -686 -536 -379 -538 -1242 -1525 -1851 -1799 -1090 -685 -328 -178 160 83 56 148 82 395 857 439 181 449 20 -478 -437 -415 -519 30 -27 -898 -676 -464 -122 448 474 227 40 148 -40 267 327 410 437 514 -33 -161 364 293 542 729 377 849 931 291 187 -124 -364 -183 50 34 -266 165 193 -435 -318 -492 -743 -273 -434 -520 -1037 -448 -251 -46 84 29 -498 -547 -414 -48 1 179 86 -77 378 170 545 597 258 515 527 248 115 -12 -79 -36 629 633 447 482 -526 -1343 -591 -544 -54 19 -145 -608 -728 -384 -428 -268 -133 -455 -102 -187 192 659 841 558 687 510 646 724 363 351 745 1157 1264 1121 1047 6 -372 -150 109 504 831 168 -128 -129 -4 -89 -387 -591 -463 -328 -494 -1230 -1558 -1978 -1987 -1239 -804 -392 -218 195 97 65 162 87 418 914 495 213 557 26 -603 -540 -497 -603 35 -33 -1137 -877 -616 -166 621 667 323 57 200 -54 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