File name: Pandora21s1_Bremen_20220401_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T102110.7Z 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_20220401_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: 20220401 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 20220401T090650.0Z 8126.379745 178 1 49.93 2 56.51 136.10 60.71 134.65 0.00 1 0.00 1 0 25 1.413e-02 4.992e-03 1.450e-02 2.845e-03 3.065268e-01 1.472131e-03 4.105811e-03 -6.000000e+00 8.390409e-03 226.44 -2.00 3.88 -2.00 318.22 0.00e+00 8.549967e-05 2.478994e-04 9.791573e-05 -6.000000e+00 3.384499e-04 270.41 -2.00 20.00 -2.00 317.92 0.00e+00 1.807 0.000 302.00 328.00 3 5.5648e+00 3.9168e-03 2.5166e-02 -6.0000e+00 2.0927e-02 2.3473e-02 4.3972e-03 1.7374e-02 -6.0000e+00 2.2748e-02 1.4058e-03 2.9268e-03 8.7613e-03 -6.0000e+00 1.3386e-02 -5.2650e-03 1.5208e-03 2.5671e-03 -6.0000e+00 5.5826e-03 2.2395e-04 -3.7902e-04 8.9589e-05 3.1979e-05 -6.0000e+00 4.2384e-04 -1.7917e-02 2.6530e-05 11 1 0 11 8 0 99.93 22.23 0.21 -0.01792 -0.02076 21 4 1 5 0 2377.254 25.28 20.00 22.23 11.11 28.1 1015.19 201 -4682 -6593 -297 -4066 -7692 -1484 -2316 3841 98 -255 -3560 306 -394 -2413 -1266 -1852 -2301 -377 -1022 -952 -847 572 3374 -756 535 -1520 -1172 -1771 1641 271 588 935 -174 2885 355 -1580 -431 -733 -693 -682 -879 -1408 -725 -238 -1342 -288 99 -900 -19 1056 1147 1515 554 607 1236 1874 289 650 134 1280 1094 948 384 804 644 -258 823 689 91 -144 -152 -214 348 -77 -656 417 272 367 -212 -1231 -895 -1243 -1035 -840 -647 -269 -73 -495 146 59 215 170 1124 423 363 879 165 -313 -385 67 -657 -186 182 -700 -440 -270 3 31 358 -167 -258 -205 100 -81 591 683 50 108 -547 -612 -322 103 -35 276 708 797 888 309 576 382 321 -22 385 207 -179 -37 91 78 -460 -469 -305 -258 12 -317 -472 -19 -253 -475 -90 -157 273 8 -20 -307 28 -42 -301 -173 -272 -357 -60 -170 -162 -145 98 595 -147 107 -312 -231 -334 295 52 122 209 -41 643 80 -383 -119 -239 -262 -285 -390 -649 -338 -111 -631 -133 45 -408 -9 496 573 803 312 354 736 1131 177 393 81 778 704 657 284 605 467 -178 547 477 70 -120 -133 -189 299 -63 -496 286 178 245 -155 -1012 -805 -1202 -1049 -895 -729 -317 -88 -608 175 67 228 168 1062 413 383 1010 207 -420 -523 88 -810 -216 211 -857 -567 -361 4 45 545 -268 -424 -334 156 -119 819 925 70 157 -839 -965 -507 159 -53 398 978 1061 1164 421 831 581 505 -35 634 356 -322 -68 171 147 -868 -863 -545 -449 SS 20220401T091239.0Z 8126.383785 181 1 50.65 2 55.91 137.69 60.08 136.12 0.00 1 0.00 1 0 25 1.872e-02 5.370e-03 1.136e-02 2.433e-03 3.000556e-01 1.258410e-03 4.030246e-03 -6.000000e+00 1.111373e-02 226.44 -2.00 3.88 -2.00 318.07 0.00e+00 2.148505e-04 2.037605e-04 9.189837e-05 -6.000000e+00 4.483028e-04 270.41 -2.00 20.00 -2.00 317.76 0.00e+00 1.779 0.000 302.00 328.00 3 5.4441e+00 3.3396e-03 2.4713e-02 -6.0000e+00 2.7719e-02 1.9937e-02 3.7442e-03 1.7017e-02 -6.0000e+00 3.0131e-02 -2.1696e-03 2.4506e-03 8.5687e-03 -6.0000e+00 1.7731e-02 -3.0659e-03 1.2645e-03 2.5030e-03 -6.0000e+00 7.3945e-03 2.6299e-04 -4.1953e-04 7.6382e-05 3.1281e-05 -6.0000e+00 5.6140e-04 -1.7787e-02 3.1844e-05 10 0 0 10 0 0 99.68 22.22 0.40 -0.01779 -0.02094 20 4 1 5 0 2531.904 25.28 20.00 22.22 11.19 28.1 1015.54 1362 -9576 -1775 -4134 -2078 -9358 -2654 -3489 -5705 2821 -8705 4132 -4102 -346 -977 1299 145 -1480 578 -2972 2515 935 3698 -1033 908 54 782 -78 124 313 -566 3130 708 489 -2426 278 -1179 -655 -264 -1872 -476 -786 479 -1242 101 -1446 -310 -168 -659 1426 147 1643 191 951 274 1419 -104 981 418 840 1662 404 1230 711 -49 95 669 -21 1024 471 -28 -45 -659 -231 -342 45 -360 239 -357 -57 -756 -1217 -1471 -992 -671 -950 -327 -250 157 -60 338 594 350 1526 802 990 493 474 -224 -386 36 -651 111 276 -682 -942 -477 -524 38 432 -71 95 -177 -68 99 579 -105 141 -152 -249 -353 -199 -44 -170 522 33 863 1098 710 268 272 -84 197 256 181 176 -65 143 -314 -95 -673 -280 -96 87 -748 -133 -306 -139 -642 -178 -261 -483 234 -823 359 -427 -40 -130 187 23 -245 98 -540 445 169 663 -203 186 12 168 -16 24 61 -116 672 168 121 -602 66 -301 -190 -90 -752 -208 -365 227 -607 49 -710 -150 -80 -311 666 73 849 106 552 166 871 -66 617 261 519 1038 270 875 539 -38 71 469 -14 724 366 -24 -40 -595 -203 -285 34 -255 160 -245 -43 -630 -1113 -1442 -1016 -721 -1081 -389 -306 192 -72 387 634 350 1454 790 1046 570 597 -301 -523 47 -806 129 320 -837 -1220 -641 -730 55 653 -113 155 -286 -105 145 800 -142 195 -219 -379 -551 -312 -68 -255 750 46 1148 1436 964 386 411 -131 313 419 307 312 -118 266 -586 -177 -1223 -493 -165 SS 20220401T092221.3Z 8126.390525 187 1 50.86 2 54.96 140.39 59.08 138.62 0.00 1 0.00 1 0 25 2.101e-02 6.276e-03 1.843e-02 3.920e-03 2.965312e-01 2.028198e-03 3.986614e-03 -6.000000e+00 1.247334e-02 226.44 -2.00 3.88 -2.00 318.13 0.00e+00 9.796860e-05 3.321434e-04 9.049180e-05 -6.000000e+00 5.031519e-04 270.41 -2.00 20.00 -2.00 317.83 0.00e+00 1.737 0.000 302.00 328.00 3 6.1527e+00 5.3874e-03 2.4281e-02 -6.0000e+00 3.1110e-02 3.4052e-02 6.0425e-03 1.6821e-02 -6.0000e+00 3.3818e-02 -3.0474e-03 3.9627e-03 8.4715e-03 -6.0000e+00 1.9901e-02 -2.7261e-03 2.0453e-03 2.4769e-03 -6.0000e+00 8.2990e-03 1.3471e-04 -3.0686e-04 1.2376e-04 3.1173e-05 -6.0000e+00 6.3011e-04 -1.7783e-02 2.2221e-05 10 0 0 10 0 0 99.32 22.22 0.34 -0.01778 -0.02009 14 3 1 5 0 3631.889 25.28 19.99 22.22 11.32 28.1 1015.80 -8862 -2807 -5416 -11370 -1849 4944 -4247 -4075 -822 2450 -7596 3405 -5387 -593 598 1990 2178 -1746 2838 -2209 791 -2801 1759 3701 5869 202 -1607 716 -2384 3170 223 798 -692 404 -2522 32 -1390 -3001 -1359 -1927 1032 -1185 -444 -1115 -495 -1158 -993 -107 -1703 1566 379 1312 1366 1670 743 59 1163 -141 -28 -241 1626 412 2277 335 1483 469 -370 386 101 1816 288 54 95 122 -275 1031 -479 -1602 442 -193 -777 -1283 -1221 -1163 -907 -687 -250 31 -169 486 -60 61 -312 1471 47 292 327 1012 -161 -430 206 -592 -1042 -365 -660 -1016 -747 -306 160 477 -118 279 -122 -109 468 401 197 298 54 -373 -775 255 281 -267 857 216 725 1078 928 437 168 366 -303 433 -465 223 -200 130 -100 -291 -367 -473 -62 -625 -206 -421 -900 -123 296 -289 -307 -66 204 -709 297 -565 -68 78 282 329 -286 465 -393 140 -516 316 687 1130 43 -347 146 -474 587 44 172 -163 98 -612 8 -347 -874 -461 -762 438 -544 -209 -537 -237 -558 -474 -50 -796 715 182 667 738 946 440 36 717 -88 -18 -148 999 271 1583 252 1123 344 -258 259 70 1375 241 47 84 106 -227 772 -332 -1066 295 -142 -637 -1160 -1183 -1184 -972 -778 -297 38 -209 584 -69 64 -309 1382 46 307 377 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