File name: Pandora257s1_AustinTX_20250417_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250418T063643.4Z 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_20250417_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: 20250417 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 20250417T154150.4Z 9238.654056 336 1 54.84 2 43.71 107.34 101.98 243.82 0.00 1 0.00 1 0 17 2.799e-02 1.443e-02 6.862e-03 3.490e-03 1.629678e-01 1.911337e-03 1.773340e-03 -6.000000e+00 1.788457e-02 229.40 -2.00 3.25 -2.00 316.24 0.00e+00 -2.104144e-04 2.241120e-04 3.781784e-05 -6.000000e+00 8.186970e-04 286.75 -2.00 20.00 -2.00 315.47 0.00e+00 1.382 0.000 302.00 328.00 3 6.9742e+00 4.9778e-03 1.5543e-02 -6.0000e+00 4.4460e-02 -3.8453e-03 5.5539e-03 7.7388e-03 -6.0000e+00 4.8018e-02 4.1853e-02 3.1702e-03 3.7380e-03 -6.0000e+00 2.8653e-02 -1.9676e-02 1.4083e-03 1.0212e-03 -6.0000e+00 1.1840e-02 1.1050e-04 7.2938e-04 1.2501e-04 1.6400e-05 -6.0000e+00 1.0112e-03 2.3984e-02 -9.8898e-05 12 8 8 10 0 0 99.99 27.91 1.27 0.02398 0.02946 51 5 1 5 0 1075.240 35.75 20.00 27.91 28.52 0.0 951.77 532 -3157 851 3189 -12674 -5474 -6163 -2277 -548 -1590 2475 -7691 -1509 7035 3344 -3629 -1436 4847 5693 3268 9856 -1969 5813 1548 1992 -2637 -1621 768 -740 2984 -98 1813 -4097 -586 -7470 8086 -8712 -1363 -2626 1327 -859 1049 3099 -2419 -758 -2222 -2306 732 -647 151 2615 3900 790 4430 -2194 -22 233 1019 955 394 -289 464 4872 -937 -2056 -2091 2334 1535 -1432 708 1091 634 -114 123 141 -77 1843 -3830 -1242 -1635 -2713 -860 -3751 -1203 894 -284 204 1079 1352 419 -1224 -655 284 -293 314 1687 1072 997 -803 -821 -326 -1165 498 372 869 -1072 -523 448 161 1322 17 -90 179 764 -77 -824 80 -732 -212 -517 -296 -422 683 2393 -772 -271 704 -555 932 -337 -833 -652 333 230 -548 239 72 1115 1397 864 -538 -1716 -512 109 -697 178 618 -2722 -1081 -1286 -494 -124 -377 575 -2063 -410 1925 1029 -1267 -509 1658 1980 1190 3409 -776 2167 624 825 -1153 -686 303 -283 1080 -37 702 -1732 -239 -3229 3069 -4282 -713 -1602 792 -565 707 2091 -1734 -531 -1557 -1575 471 -455 106 1845 2845 565 3165 -1717 -17 182 789 738 310 -237 399 4202 -875 -1896 -1817 1832 1198 -1207 632 1039 629 -114 118 127 -64 1515 -3206 -1041 -1488 -2484 -838 -4016 -1331 1031 -352 264 1418 1765 531 -1472 -719 286 -288 316 1804 1255 1255 -1067 -1078 -407 -1389 570 436 1074 -1427 -726 644 222 1875 25 -133 253 1091 -103 -1051 100 -956 -292 -753 -443 -635 993 3289 -1042 -346 858 -683 1167 -447 -1152 -924 477 342 -858 388 110 1737 2182 1337 -825 -2831 -825 SS 20250417T154926.1Z 9238.659330 342 1 0.27 2 42.15 108.84 103.41 244.60 0.00 1 0.00 1 0 17 7.648e-03 6.432e-03 3.939e-03 2.991e-03 1.713804e-01 1.694012e-03 1.930240e-03 -6.000000e+00 4.883436e-03 229.40 -2.00 3.25 -2.00 314.46 0.00e+00 5.845308e-04 1.376777e-04 1.501799e-05 -6.000000e+00 2.237827e-04 286.75 -2.00 20.00 -2.00 313.85 0.00e+00 1.347 0.000 302.00 328.00 3 1.8984e+00 4.3272e-03 1.5519e-02 -6.0000e+00 1.2139e-02 1.1132e-02 4.7758e-03 8.2299e-03 -6.0000e+00 1.3115e-02 8.1289e-04 2.7333e-03 3.9845e-03 -6.0000e+00 7.8254e-03 -5.3974e-03 1.1440e-03 1.1449e-03 -6.0000e+00 3.2311e-03 1.8069e-02 -9.4071e-04 1.0620e-04 2.0063e-05 -6.0000e+00 2.7636e-04 2.3872e-02 -3.3745e-04 12 9 1 12 9 1 69.95 27.92 0.36 0.02387 0.01680 3 82 1 5 0 64.630 35.75 19.99 27.92 28.94 0.0 955.05 213 -956 -2008 -1968 -1207 -697 608 478 1006 -539 -1424 604 -127 188 426 -677 -594 676 816 821 877 -182 1038 1378 794 -50 -11 -256 -10 1202 1741 1507 701 -1471 -1659 -651 -227 -504 303 -439 -1171 -1076 -1444 -761 -809 -250 -952 -665 -388 -7 1372 961 882 879 337 775 380 257 486 999 1575 1167 675 910 352 -204 -144 372 734 1007 -23 166 -60 27 -256 -549 -281 -306 -21 -278 -1061 -1500 -2056 -1459 -1058 -729 -326 -157 75 -142 105 384 -181 754 682 364 108 73 444 -339 -391 -580 -562 473 -126 -755 -802 -620 -272 611 468 153 161 -237 -19 395 389 390 208 419 -118 176 -29 428 785 1096 205 1098 594 -185 286 -338 -278 -54 137 140 -180 155 86 -462 -481 -375 -649 85 -399 -834 -773 -468 -264 237 190 422 -236 -609 265 -58 94 219 -357 -325 374 463 455 492 -104 597 814 485 -29 -6 -148 -6 674 991 895 414 -887 -990 -393 -143 -336 223 -339 -950 -883 -1214 -640 -677 -211 -791 -536 -315 -5 1136 809 752 776 297 691 342 231 435 898 1459 1112 660 884 346 -196 -134 340 680 978 -24 171 -62 28 -253 -513 -257 -268 -19 -263 -1044 -1564 -2181 -1631 -1191 -848 -386 -191 91 -169 120 422 -192 785 732 399 126 88 537 -409 -462 -667 -645 549 -152 -921 -1003 -809 -361 821 634 207 215 -311 -23 475 475 479 265 550 -156 234 -39 546 997 1355 246 1302 731 -235 366 -438 -368 -72 187 195 -260 223 125 -666 -691 -525 -919 SS 20250417T155702.7Z 9238.664615 348 1 0.67 2 40.60 110.42 104.84 245.36 0.00 1 0.00 1 0 17 1.093e-02 8.260e-03 6.577e-03 4.984e-03 1.647697e-01 2.820054e-03 1.838568e-03 -6.000000e+00 6.986109e-03 229.40 -2.00 3.25 -2.00 314.45 0.00e+00 3.632806e-04 2.289255e-04 5.067254e-05 -6.000000e+00 3.197839e-04 286.75 -2.00 20.00 -2.00 313.84 0.00e+00 1.316 0.000 302.00 328.00 3 3.4740e+00 7.2034e-03 1.5064e-02 -6.0000e+00 1.7367e-02 1.5397e-02 7.9567e-03 7.8534e-03 -6.0000e+00 1.8757e-02 3.3436e-03 4.5524e-03 3.8132e-03 -6.0000e+00 1.1192e-02 -4.3218e-03 1.9029e-03 1.1026e-03 -6.0000e+00 4.6254e-03 3.8991e-03 1.4628e-04 1.7688e-04 1.9401e-05 -6.0000e+00 3.9499e-04 2.3582e-02 -1.0007e-04 12 9 1 12 1 1 999.00 27.94 0.17 0.02358 0.02468 1 16 1 5 0 332.190 35.75 20.00 27.94 29.37 0.0 958.03 -1549 -1196 -2397 -2092 -2823 -865 2359 2768 964 -1647 -3858 -99 -324 2044 1095 443 -1845 1070 946 676 591 1249 202 759 198 -1141 1104 -1237 1163 170 775 3839 1847 -724 -1651 -1433 -772 825 -182 405 -1036 -807 -718 -504 -1278 -374 -600 25 -781 584 2359 568 555 13 1466 422 1386 923 523 969 1947 868 611 690 -610 -218 -564 -277 245 198 -623 15 84 835 -640 -1481 -897 257 -739 -1089 -960 -1499 -1392 -2425 -1346 -891 -468 64 755 448 -594 261 215 1379 481 908 133 931 -124 -407 -290 342 -664 515 451 -1467 -302 -919 168 434 453 -134 270 286 -95 -152 -84 365 510 -141 -500 435 433 592 780 524 294 717 1289 455 451 18 -251 -512 593 -360 -438 3 183 -840 -36 122 -1294 -615 -490 -977 -804 -1099 -324 891 1118 394 -711 -1733 -45 -149 1001 554 239 -999 577 523 382 338 716 119 459 118 -691 672 -735 644 93 431 2147 1083 -435 -989 -875 -484 554 -136 321 -859 -669 -608 -428 -1088 -311 -507 21 -629 464 1898 487 476 12 1323 375 1229 821 465 867 1785 816 605 674 -612 -205 -522 -252 232 195 -639 16 89 846 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