File name: Pandora257s1_AustinTX_20241208_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20241209T093209.8Z 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_20241208_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: 20241208 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 20241208T195119.7Z 9108.827311 270 1 19.82 2 57.11 204.29 78.90 103.42 0.00 1 0.00 1 0 17 1.137e-02 6.297e-03 3.002e-03 1.517e-03 2.258415e-01 8.281480e-04 2.530256e-03 -6.000000e+00 7.134482e-03 224.29 -2.00 3.25 -2.00 316.09 0.00e+00 1.721316e-04 9.491940e-05 4.254355e-05 -6.000000e+00 3.305464e-04 285.31 -2.00 20.00 -2.00 315.37 0.00e+00 1.835 0.000 302.00 328.00 3 4.4555e+00 2.1290e-03 2.0734e-02 -6.0000e+00 1.7534e-02 -1.0802e-02 2.3783e-03 1.0570e-02 -6.0000e+00 1.9003e-02 1.0245e-02 1.3662e-03 5.2168e-03 -6.0000e+00 1.1376e-02 -7.0263e-03 6.1521e-04 1.4786e-03 -6.0000e+00 4.7466e-03 8.0324e-04 4.1509e-04 5.3767e-05 2.4036e-05 -6.0000e+00 4.1003e-04 1.9940e-02 -8.2636e-06 12 1 1 12 1 1 99.60 26.76 0.24 0.01994 0.02306 20 6 1 5 0 943.760 35.00 20.01 26.76 22.43 0.0 906.83 -1575 -1979 -2182 -1693 -7632 -2197 -939 -1009 -1039 -2236 -1220 -1219 -548 2371 2019 13 -826 695 701 1875 2539 271 2463 1329 -35 363 -42 -154 -720 1581 1391 194 -179 -266 -2470 181 -1581 -753 -495 -531 -519 -823 -222 -798 -417 -697 -744 316 -698 -334 469 1469 231 1080 562 596 664 608 267 604 1123 1755 1726 1212 -70 -532 -77 -213 586 1027 171 233 -169 482 -187 -93 -593 -938 -267 -751 -1360 -1604 -1888 -1894 -1005 -373 -238 -99 201 96 112 161 128 188 750 826 651 520 167 -274 -219 -652 -412 99 -44 -932 -729 -344 -105 554 565 216 58 46 -105 90 255 86 129 266 -96 -210 252 82 320 703 283 526 1105 18 250 -199 -239 13 177 12 -384 57 255 -149 -410 -331 -526 -306 -405 -446 -329 -1494 -402 -178 -207 -229 -519 -289 -306 -150 702 607 4 -288 248 258 699 957 106 966 548 -15 159 -18 -64 -291 620 565 84 -81 -122 -1148 84 -753 -408 -287 -348 -344 -576 -158 -578 -301 -499 -523 216 -475 -229 333 1088 171 826 445 481 541 495 217 494 948 1466 1528 1114 -65 -468 -68 -188 507 960 164 231 -169 461 -178 -81 -512 -787 -230 -667 -1341 -1634 -1960 -2089 -1170 -436 -291 -124 251 115 132 176 138 198 816 919 756 655 209 -343 -275 -777 -500 115 -54 -1169 -959 -474 -145 795 804 311 84 64 -141 114 337 112 177 366 -137 -299 349 115 426 934 366 677 1471 24 353 -279 -343 20 263 18 -596 90 403 -233 -653 -512 -805 SS 20241208T195549.3Z 9108.830432 273 1 2.02 2 57.52 205.42 77.97 104.00 0.00 1 0.00 1 0 17 1.331e-02 7.588e-03 8.416e-03 4.511e-03 2.279043e-01 2.465268e-03 2.570735e-03 -6.000000e+00 8.355592e-03 224.29 -2.00 3.25 -2.00 315.97 0.00e+00 2.271168e-04 2.762927e-04 3.488935e-05 -6.000000e+00 3.871781e-04 285.31 -2.00 20.00 -2.00 315.26 0.00e+00 1.856 0.000 302.00 328.00 3 4.0148e+00 6.3355e-03 2.0968e-02 -6.0000e+00 2.0535e-02 -1.0262e-02 7.0768e-03 1.0698e-02 -6.0000e+00 2.2256e-02 1.2087e-02 4.0487e-03 5.2798e-03 -6.0000e+00 1.3324e-02 -8.3561e-03 1.8070e-03 1.5013e-03 -6.0000e+00 5.5587e-03 1.2185e-03 9.5073e-05 1.5975e-04 2.4734e-05 -6.0000e+00 4.8026e-04 1.9315e-02 -6.1326e-05 12 9 1 12 1 1 999.00 26.78 0.31 0.01932 0.02003 2 8 1 5 0 670.510 35.25 20.00 26.78 22.40 0.0 906.77 -53 235 -3749 -5054 -6415 -4095 312 1325 289 -1286 -1880 -2610 972 2676 978 -92 -1082 1013 1768 1712 2529 950 1845 2080 -460 6 -3269 1068 -1279 2327 370 1747 -321 -869 -2108 1460 -2871 -1899 -396 -202 -496 -313 -529 -296 89 -790 -1189 -370 -133 204 385 1532 644 1323 720 -141 272 628 917 1523 600 2194 1333 865 34 -1532 -352 -368 1164 1505 -148 210 -67 -378 98 650 -660 -343 -308 24 -1352 -2042 -1615 -2107 -920 -756 -222 -128 -254 417 714 -54 -47 -84 779 710 610 795 -274 -569 -384 -143 -639 -208 148 -983 -1154 178 -87 585 279 173 136 430 -230 500 703 830 -8 -112 -520 -239 206 187 -140 454 642 953 1039 616 546 -267 25 233 -372 -301 -503 -179 29 105 -676 357 -738 -11 53 -874 -1142 -1395 -860 66 299 71 -305 -464 -687 271 818 336 -32 -396 377 674 670 998 386 762 892 -195 3 -1422 461 -545 952 160 784 -142 -391 -954 654 -1467 -1029 -245 -131 -331 -219 -381 -215 65 -572 -848 -256 -91 141 276 1146 483 1028 580 -117 227 521 756 1260 519 1873 1216 778 31 -1401 -303 -315 1029 1367 -146 206 -66 -378 91 581 -584 -293 -271 22 -1303 -2061 -1742 -2316 -1064 -887 -271 -154 -305 502 839 -59 -50 -88 836 787 710 1001 -349 -722 -485 -170 -740 -244 182 -1244 -1537 236 -121 820 406 255 194 599 -313 640 889 1081 -11 -157 -726 -332 291 253 -189 583 829 1227 1332 836 746 -380 37 338 -569 -464 -804 -281 45 168 -1063 541 -1115 SS 20241208T200428.7Z 9108.836443 279 1 11.63 2 58.35 207.56 76.19 105.13 0.00 1 0.00 1 0 17 3.415e-02 1.228e-02 1.511e-02 5.693e-03 2.265496e-01 3.077474e-03 2.528308e-03 -6.000000e+00 2.143269e-02 224.29 -2.00 3.25 -2.00 316.92 0.00e+00 8.589441e-04 4.305781e-04 7.558066e-05 -6.000000e+00 9.931520e-04 285.31 -2.00 20.00 -2.00 316.17 0.00e+00 1.899 0.000 302.00 328.00 3 5.8065e+00 8.0187e-03 2.1302e-02 -6.0000e+00 5.2672e-02 -2.3962e-03 9.0204e-03 1.0731e-02 -6.0000e+00 5.7090e-02 3.0952e-02 5.2566e-03 5.2583e-03 -6.0000e+00 3.4177e-02 -1.7472e-02 2.4549e-03 1.6592e-03 -6.0000e+00 1.4258e-02 1.9307e-04 3.1157e-04 2.0376e-04 2.4836e-05 -6.0000e+00 1.2319e-03 1.9820e-02 -4.8177e-05 12 9 9 12 1 1 999.00 26.82 0.45 0.01982 0.02216 2 1 1 5 0 3873.270 35.25 20.00 26.82 22.52 0.0 908.60 -7023 -7162 -6543 12041 -17773 -10861 -4520 -5307 6937 2674 7085 -6887 -220 7953 7310 -1786 -1839 8419 -575 6832 8143 -3172 4202 632 -663 -4741 -2611 1642 -3765 1499 1385 2248 481 1513 -3886 4182 -5771 -4869 701 -1343 1845 804 2700 -180 -2055 -2072 -5266 2518 -1026 -346 1760 3584 -411 1888 -24 -75 -1137 590 874 90 430 1433 4639 1523 -2472 74 -401 966 150 1815 388 2050 421 -163 324 250 -433 -2897 -864 -688 -2315 -2834 -2440 -1174 -498 -332 86 -256 647 33 113 -375 192 233 530 1438 1305 -48 112 137 78 -1250 -380 339 -76 -481 -1005 526 -58 376 771 -26 -421 289 -105 289 537 -762 -1312 -741 58 -690 1422 1308 -424 68 310 811 1592 691 -672 -611 159 704 -26 -69 -645 -274 1369 786 -1061 -690 -689 -983 -1058 -959 1404 -2654 -1495 -612 -784 971 407 1066 -1266 -42 1554 1591 -459 -498 2141 -165 1874 2242 -991 1250 203 -223 -1684 -894 520 -1217 458 440 748 170 534 -1439 1465 -2442 -2128 335 -739 1067 494 1674 -116 -1351 -1352 -3487 1513 -633 -215 1113 2348 -295 1380 -17 -54 -832 424 624 65 323 1130 3756 1315 -2196 61 -317 747 123 1587 370 1994 416 -157 289 205 -331 -2398 -665 -576 -2175 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