File name: Pandora21s1_Bremen_20210410_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T065240.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20210410_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20210410 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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 20210410T074228.3Z 7770.321161 142 1 50.69 2 63.53 113.67 66.93 136.13 0.00 1 0.00 1 0 25 1.991e-02 4.901e-03 1.387e-02 1.578e-03 3.838857e-01 8.188352e-04 5.064737e-03 -6.000000e+00 1.183070e-02 227.19 -2.00 3.88 -2.00 318.91 0.00e+00 2.305086e-04 1.694122e-04 1.592505e-04 -6.000000e+00 4.771249e-04 271.54 -2.00 20.00 -2.00 318.60 0.00e+00 2.231 0.000 302.00 328.00 3 4.0028e+00 2.2135e-03 3.1394e-02 -6.0000e+00 2.9553e-02 4.4129e-02 2.5104e-03 2.1865e-02 -6.0000e+00 3.2140e-02 -7.5944e-04 1.8782e-03 1.1085e-02 -6.0000e+00 1.8902e-02 -6.0540e-03 1.0041e-03 3.2724e-03 -6.0000e+00 7.8438e-03 6.2323e-04 -6.4147e-04 4.9485e-05 4.0340e-05 -6.0000e+00 5.9800e-04 1.6501e-03 -2.1459e-05 10 0 0 10 0 0 99.84 22.30 0.11 0.00165 -0.00317 87 17 1 5 0 575.963 25.28 20.00 22.30 13.87 23.5 1019.63 -4708 10641 -8128 524 -9912 3552 1103 2403 878 -2663 1308 -8629 -900 -3865 3969 -2101 -959 -3011 -1157 -553 -1597 679 -2047 1427 -1694 1278 -1547 -1268 1222 1112 1339 -1036 1215 -3092 346 -2593 156 -1346 -973 -1269 -1911 -926 -1334 -491 -831 -693 -330 202 -594 1017 477 161 906 348 1243 698 1109 269 837 1130 1159 1151 922 646 -191 1124 90 950 868 708 -139 -119 76 -316 209 -230 871 446 511 -553 -427 -899 -1508 -1257 -942 -722 -521 -221 -177 -87 289 579 935 947 1096 561 847 121 -243 -394 -286 -321 461 -52 -798 -445 -652 -286 108 132 -198 -121 2 -82 154 505 518 120 -8 -666 -718 -287 -98 85 244 439 699 1010 575 570 175 288 71 230 -18 34 144 -46 -287 -266 -200 -356 -93 -156 339 -318 18 -356 111 37 89 37 -122 60 -460 -51 -263 292 -183 -89 -304 -121 -60 -179 75 -240 172 -224 172 -214 -169 154 141 183 -161 202 -556 59 -451 29 -290 -248 -377 -631 -321 -481 -179 -305 -255 -121 73 -218 378 188 69 410 168 618 359 580 142 433 580 609 644 560 420 -128 717 56 575 556 501 -108 -96 62 -248 154 -156 541 269 322 -389 -336 -781 -1410 -1233 -971 -784 -591 -257 -206 -99 311 580 879 874 1056 591 980 153 -327 -534 -373 -391 530 -60 -974 -569 -869 -396 156 202 -319 -200 4 -129 230 718 727 173 -12 -1052 -1157 -458 -152 129 355 615 946 1360 813 860 279 475 121 402 -32 64 280 -91 -570 -521 -380 -656 -167 SS 20210410T074733.0Z 7770.324688 145 1 2.10 2 62.84 114.85 66.40 137.35 0.00 1 0.00 1 0 25 1.511e-02 6.021e-03 1.029e-02 2.429e-03 3.739232e-01 1.261309e-03 4.970588e-03 -6.000000e+00 8.979904e-03 227.19 -2.00 3.88 -2.00 317.61 0.00e+00 2.492809e-04 1.840495e-04 1.067236e-04 -6.000000e+00 3.620791e-04 271.54 -2.00 20.00 -2.00 317.31 0.00e+00 2.179 0.000 302.00 328.00 3 2.4002e+00 3.3321e-03 3.0506e-02 -6.0000e+00 2.2432e-02 2.9719e-02 3.7264e-03 2.1099e-02 -6.0000e+00 2.4394e-02 -1.3763e-02 2.3560e-03 1.0550e-02 -6.0000e+00 1.4347e-02 2.5119e-03 1.1990e-03 3.0370e-03 -6.0000e+00 5.9545e-03 3.3419e-03 -2.9985e-04 7.3472e-05 3.7755e-05 -6.0000e+00 4.5379e-04 1.3318e-03 2.8805e-05 12 1 1 12 1 1 -25.36 22.31 0.18 0.00133 -0.00092 10 55 1 5 0 175.324 25.28 19.99 22.31 14.08 23.4 1020.91 -2385 -3946 787 -8598 3989 -8189 -1202 -3224 -1356 -2126 -857 -19 -4101 439 -3133 1528 -2835 929 -1228 -1730 1231 -64 1195 -356 888 -1095 -1705 -1900 2159 -1226 232 356 340 232 -252 -103 -1943 139 -499 -1250 -1232 -290 -456 -631 -85 -1046 379 135 513 305 625 1743 730 512 1072 1128 597 891 781 1429 1399 1236 1115 -177 -40 242 163 606 1021 -343 -71 -528 203 -469 39 664 -492 598 70 309 -777 -1110 -1328 -1473 -1450 -1535 -466 -540 -146 113 21 146 713 1100 1161 1160 231 195 -640 -317 -432 -155 192 195 -783 -900 -346 -303 234 83 -145 157 -159 -34 290 425 477 604 -30 -469 -366 -116 -236 -72 283 52 1332 1028 598 767 371 -90 178 507 -84 -196 136 28 -537 -261 -299 -281 -478 -167 -313 61 -706 267 -600 -87 -268 -123 -206 -85 -2 -484 58 -502 249 -521 174 -248 -365 258 -14 260 -80 209 -274 -429 -460 506 -299 57 97 102 69 -77 -31 -614 50 -208 -564 -617 -147 -240 -338 -45 -565 201 71 269 165 357 1025 449 334 727 760 413 614 530 988 959 909 867 -145 -33 193 127 465 803 -296 -65 -494 189 -437 34 550 -389 450 56 264 -716 -1078 -1360 -1559 -1589 -1749 -554 -647 -174 134 24 158 732 1129 1218 1309 280 249 -864 -420 -557 -193 228 233 -975 -1164 -456 -410 327 122 -218 243 -243 -50 419 589 649 845 -43 -692 -553 -173 -351 -105 402 71 1798 1386 817 1108 562 -140 279 806 -138 -335 234 50 -937 -455 -511 -469 -792 SS 20210410T075247.6Z 7770.328328 148 1 3.15 2 62.13 116.07 65.87 138.63 0.00 1 0.00 1 0 25 2.988e-02 7.812e-03 2.387e-02 5.392e-03 3.668056e-01 2.804831e-03 4.899841e-03 -6.000000e+00 1.775409e-02 227.19 -2.00 3.88 -2.00 317.69 0.00e+00 5.644959e-04 4.177319e-04 1.070619e-04 -6.000000e+00 7.159653e-04 271.55 -2.00 20.00 -2.00 317.39 0.00e+00 2.128 0.000 302.00 328.00 3 4.1114e+00 7.4207e-03 2.9913e-02 -6.0000e+00 4.4350e-02 3.8964e-02 8.2968e-03 2.0777e-02 -6.0000e+00 4.8231e-02 -1.1865e-02 5.3075e-03 1.0391e-02 -6.0000e+00 2.8366e-02 4.1299e-04 2.7173e-03 2.9902e-03 -6.0000e+00 1.1772e-02 6.3590e-04 -7.3352e-04 1.6417e-04 3.7354e-05 -6.0000e+00 8.9734e-04 6.3350e-04 -3.7028e-05 12 9 1 12 1 1 999.00 22.31 0.26 0.00063 -0.00488 2 10 1 5 0 993.181 25.28 20.00 22.31 14.42 23.5 1023.01 -5894 927 -2556 -1320 -4146 -24229 -7170 -4138 -10669 2907 1941 2374 11252 6501 3063 -452 -3291 1570 -3186 315 266 -488 3369 -5316 1909 -374 2782 -2608 -645 865 -1238 3242 356 -731 1096 363 950 -1120 -3157 -952 -700 -1330 -690 -1525 -852 -1484 805 -993 1067 487 2697 1112 1787 694 1268 12 242 942 716 1614 926 2103 1965 699 -470 426 465 -220 929 411 -544 -1461 -1303 48 486 -192 -400 135 -582 -474 -1115 -2390 -1206 -1143 -520 -143 12 202 -47 -796 787 274 957 1014 1015 1664 887 116 -535 -545 -941 -164 555 -331 -891 -432 -1234 -351 172 53 -8 -533 383 -81 315 908 941 463 928 -1308 -602 -58 -374 70 446 562 317 1243 418 531 419 -132 752 -361 18 -371 353 -365 -277 -387 -375 -43 -70 -404 66 -194 -95 -287 -1955 -523 -326 -982 251 173 224 1108 775 432 -73 -582 281 -621 62 53 -99 678 -1213 433 -90 650 -618 -145 194 -300 827 100 -215 310 103 285 -387 -1276 -426 -339 -677 -359 -809 -452 -792 422 -523 556 259 1475 650 1093 446 836 8 166 645 486 1084 636 1503 1491 561 -386 338 356 -168 731 349 -493 -1376 -1229 44 424 -158 -311 102 -454 -398 -1021 -2360 -1242 -1220 -574 -164 14 244 -57 -952 897 298 992 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