File name: Pandora257s1_AustinTX_20250605_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250606T063326.3Z 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 v1.8.75 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250605_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: 20250605 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 20250605T124857.2Z 9287.533996 126 1 54.66 2 74.89 72.33 149.02 316.24 0.00 1 0.00 1 0 17 8.772e-02 6.097e-03 1.344e-02 1.090e-03 4.552428e-01 6.047433e-04 4.845679e-03 -6.000000e+00 5.635513e-02 230.96 -2.00 3.25 -2.00 319.23 0.00e+00 -1.391886e-04 1.659746e-04 4.350519e-04 -6.000000e+00 2.607162e-03 290.60 -2.00 20.00 -2.00 318.39 0.00e+00 3.761 0.001 302.00 328.00 3 2.5518e+00 1.7191e-03 4.2878e-02 -6.0000e+00 1.4044e-01 -3.5376e-03 2.0085e-03 2.2295e-02 -6.0000e+00 1.5142e-01 -1.2512e-02 1.4452e-03 1.0724e-02 -6.0000e+00 9.0455e-02 -3.1355e-03 7.4058e-04 2.8894e-03 -6.0000e+00 3.7405e-02 6.3506e-04 1.5600e-04 3.7782e-05 4.1406e-05 -6.0000e+00 3.1717e-03 2.8315e-02 -3.1103e-05 10 0 0 10 0 0 99.99 28.15 0.31 0.02832 0.02949 336 32 1 5 0 162.650 36.00 20.00 28.15 31.64 0.0 972.36 -19202 -12466 -34342 -22297 -45155 -34922 -36304 -24767 -17655 -35502 -14964 -23252 -13838 1846 1064 -8954 -727 4926 6931 2880 6817 -3798 9108 1500 259 -5478 -4697 -3102 -3555 -323 -948 -1864 -3197 -1648 -4877 5693 -3504 -1152 -1059 1052 -1104 -306 1378 -2034 -45 -1557 -1003 1258 -978 721 1271 2697 1141 2686 68 678 571 542 60 780 805 1057 2449 843 -319 -405 1470 821 182 1327 437 346 -45 240 409 -62 386 -1295 -395 -742 -1453 -1131 -2155 -1677 -590 -474 -28 214 566 488 -87 365 57 179 761 586 169 336 -34 -775 -464 -704 -395 206 -206 -1327 -845 -200 -144 417 311 93 50 99 -65 48 456 368 332 115 -170 -258 128 618 242 352 227 582 731 -4 6 -269 -143 -166 6 17 -197 345 411 -265 -214 -255 -437 -380 -252 -887 -502 -1253 -895 -1023 -692 -507 -1317 -492 -937 -594 80 54 -568 -47 321 469 213 500 -321 712 135 25 -581 -496 -318 -368 -34 -110 -243 -457 -240 -747 822 -620 -234 -230 257 -305 -89 412 -642 -14 -499 -322 400 -328 251 474 1076 499 1129 31 316 271 258 29 374 403 568 1408 523 -188 -254 895 518 115 915 328 270 -35 179 283 -40 252 -862 -259 -550 -1139 -982 -2054 -1591 -591 -504 -31 227 636 529 -89 350 57 168 762 655 199 410 -44 -1005 -573 -867 -465 243 -257 -1669 -1120 -280 -205 635 477 147 78 149 -98 69 657 549 522 179 -267 -401 204 942 355 496 333 824 1106 -6 10 -454 -252 -308 11 34 -397 671 799 -529 -411 -472 -800 SS 20250605T125727.4Z 9287.539901 129 1 3.04 2 73.13 73.25 150.23 319.47 0.00 1 0.00 1 0 17 6.828e-02 8.730e-03 6.511e-02 6.279e-03 4.116412e-01 3.473932e-03 4.419921e-03 -6.000000e+00 4.386787e-02 230.96 -2.00 3.25 -2.00 318.81 0.00e+00 1.512739e-04 8.261217e-04 3.982827e-04 -6.000000e+00 2.029417e-03 290.60 -2.00 20.00 -2.00 317.94 0.00e+00 3.393 0.000 302.00 328.00 3 3.3369e+00 9.6540e-03 3.8697e-02 -6.0000e+00 1.0932e-01 -1.2915e-04 1.1142e-02 2.0111e-02 -6.0000e+00 1.1787e-01 2.1097e-03 7.5812e-03 9.6930e-03 -6.0000e+00 7.0412e-02 -8.0757e-03 3.8630e-03 2.6263e-03 -6.0000e+00 2.9117e-02 4.2637e-04 5.0243e-05 2.1925e-04 3.7020e-05 -6.0000e+00 2.4689e-03 2.8314e-02 -2.6278e-05 12 9 1 12 1 1 92.35 28.16 0.25 0.02831 0.02869 4 9 1 5 0 606.730 36.00 20.00 28.16 32.03 0.0 975.52 27022 -22432 3469 29447 -1169 -15898 -12116 7639 -13937 -40286 -9255 -21899 -15292 8719 2040 -1051 -5689 7748 11117 4392 11832 -998 6418 464 5050 -15123 1282 2365 -2029 5738 1279 204 2340 -5216 -5010 10269 -4243 -3407 -1244 -4408 -688 -2279 5555 212 190 -1420 -1888 -258 -463 -375 -2270 4509 138 572 222 479 2639 101 1091 -432 354 1192 2718 754 -488 157 2536 232 569 447 1696 1098 674 84 195 -355 398 -1275 -801 -2962 -1830 -671 -1911 -1463 247 -955 -304 424 156 1060 -885 -205 483 -426 880 848 385 1241 -563 -839 -837 -1340 176 -725 886 -463 -314 -503 155 128 573 -290 219 229 470 -487 381 819 -529 601 -57 -642 -489 1106 -154 872 273 51 438 -190 547 43 -207 156 -960 297 -212 291 634 -271 -213 -607 -116 530 -783 96 613 -32 -516 -408 234 -580 -2344 -425 -1274 -964 507 146 -87 -537 683 1001 441 1137 -112 703 57 631 -2380 171 307 -275 748 190 34 406 -1006 -976 1792 -953 -806 -339 -1418 -235 -841 1967 81 73 -558 -747 -101 -186 -158 -955 1914 66 288 117 260 1429 56 599 -243 206 683 1657 495 -328 103 1585 151 398 344 1292 874 536 65 150 -253 265 -860 -575 -2255 -1551 -623 -1816 -1479 262 -1021 -339 480 176 1145 -916 -210 471 -421 917 919 468 1543 -750 -1116 -1062 -1606 211 -891 1061 -595 -426 -686 224 189 887 -463 342 343 700 -703 544 1204 -785 921 -89 -999 -741 1675 -225 1217 375 71 652 -291 885 70 -351 276 -1727 553 -410 570 1237 -522 -394 -1090 -214 SS 20250605T130247.6Z 9287.543606 133 1 54.75 2 72.03 73.82 150.95 321.61 0.00 1 0.00 1 0 25 3.556e-02 5.493e-03 4.212e-03 6.419e-04 3.931735e-01 3.550119e-04 4.230125e-03 -6.000000e+00 2.284152e-02 230.96 -2.00 3.25 -2.00 318.42 0.00e+00 5.440623e-04 7.478334e-05 2.985639e-04 -6.000000e+00 1.056833e-03 290.60 -2.00 20.00 -2.00 317.54 0.00e+00 3.197 0.000 302.00 328.00 3 2.1830e+00 9.7092e-04 3.6558e-02 -6.0000e+00 5.6924e-02 1.2668e-03 1.1064e-03 1.9063e-02 -6.0000e+00 6.1376e-02 -1.2917e-02 7.1001e-04 9.1992e-03 -6.0000e+00 3.6663e-02 -1.3085e-03 3.5682e-04 2.5437e-03 -6.0000e+00 1.5160e-02 1.6684e-03 8.6137e-05 2.2451e-05 3.6130e-05 -6.0000e+00 1.2856e-03 2.8167e-02 -5.6842e-05 10 0 0 10 0 0 99.98 28.17 0.33 0.02817 0.02881 712 69 1 5 0 76.880 36.00 19.99 28.17 32.31 0.0 977.79 -10463 -11771 -13819 -12817 -16493 -14228 -10849 -8121 -7029 -10835 -9656 -7538 -5872 142 -1029 -3247 -2243 2169 963 631 1402 -192 2244 401 410 -1626 -2186 -1067 -1966 -99 270 -513 -524 -1120 -3608 563 -1879 -987 -639 580 -1013 -551 305 -781 327 -220 -217 549 -165 322 1330 1504 1138 1613 505 853 904 549 622 679 1045 1433 1909 993 178 -405 442 258 762 980 245 288 27 64 20 -304 -258 -660 -360 -708 -1270 -1399 -1934 -1659 -726 -543 -206 11 320 422 -89 320 183 292 652 491 250 373 4 -542 -568 -664 -584 -65 -171 -1040 -810 -347 -86 295 259 140 41 71 -19 130 360 315 404 278 -106 -92 385 492 323 563 190 524 903 139 -22 -160 -219 -62 93 37 -150 197 200 -321 -248 -308 -535 -439 -541 -660 -591 -766 -654 -517 -415 -387 -662 -624 -530 -468 12 -105 -376 -279 275 130 89 201 -29 343 66 71 -268 -398 -188 -348 -18 48 -100 -110 -242 -808 126 -479 -290 -201 206 -401 -231 131 -346 144 -98 -97 244 -75 153 615 748 609 909 300 483 520 317 358 395 632 926 1323 682 124 -297 314 187 552 777 198 241 22 51 16 -224 -191 -488 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