File name: Pandora21s1_Bremen_20210220_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T062535.3Z 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_20210220_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: 20210220 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 20210220T094326.1Z 7721.405163 200 1 50.21 2 68.41 149.45 91.47 52.37 0.00 1 0.00 1 0 17 4.029e-02 5.886e-03 3.788e-02 4.270e-03 3.634467e-01 2.189644e-03 4.782595e-03 -6.000000e+00 2.362587e-02 223.77 -2.00 3.88 -2.00 319.01 0.00e+00 7.156642e-04 4.672399e-04 1.562781e-04 -6.000000e+00 9.651820e-04 266.34 -2.00 20.00 -2.00 318.71 0.00e+00 2.694 0.000 302.00 328.00 3 5.1725e+00 5.9064e-03 3.3517e-02 -6.0000e+00 5.8564e-02 7.6243e-02 6.7202e-03 2.0372e-02 -6.0000e+00 6.3846e-02 -4.6894e-03 5.0684e-03 1.0419e-02 -6.0000e+00 3.7644e-02 -6.8617e-03 2.7183e-03 3.1376e-03 -6.0000e+00 1.5729e-02 1.3024e-04 -4.7650e-04 1.3560e-04 3.9069e-05 -6.0000e+00 1.2087e-03 2.5846e-03 -2.5503e-05 12 1 1 12 1 1 99.95 22.25 0.22 0.00258 -0.00100 16 3 1 5 0 2952.747 25.28 20.00 22.25 16.35 23.0 1033.58 -50 -9305 -12657 -14315 940 19765 11782 5692 6435 4971 21076 -11548 3864 7132 -11707 -1474 -2668 2108 6170 -2446 -2135 -2067 10171 -1583 -572 -527 -1694 1727 1119 -6244 -6192 603 1298 -1907 1717 3341 -2681 482 -983 -1669 -2318 -279 -766 -627 -991 -590 -354 114 -131 323 -1331 -274 -1085 2133 1949 1214 1311 1101 1301 1038 1273 999 1013 377 896 880 -1077 -367 685 833 -319 242 576 -1232 -959 -39 623 -534 -25 -466 -638 -912 -688 -662 -1325 -320 -565 -162 -215 -168 184 1438 749 851 9 653 1155 1233 303 441 -469 -447 -191 -340 -965 -1167 -388 -677 94 375 -31 35 -81 -382 -457 198 -408 89 -13 -159 -332 558 -171 543 540 430 432 976 228 154 245 -365 66 -77 -221 -269 147 644 30 82 -72 -358 -621 -2 -370 -537 -593 32 544 369 210 260 216 810 -642 212 444 -1012 -129 -255 204 604 -270 -241 -235 1058 -195 -74 -71 -232 221 139 -838 -895 90 211 -332 281 536 -492 100 -245 -487 -752 -94 -269 -223 -356 -212 -127 40 -47 117 -520 -114 -486 982 934 603 663 558 649 516 648 545 600 240 579 547 -648 -217 425 572 -241 190 453 -951 -693 -25 373 -313 -15 -317 -488 -772 -624 -632 -1346 -342 -635 -186 -249 -189 195 1400 687 764 8 674 1312 1536 404 590 -605 -538 -217 -387 -1167 -1492 -514 -939 136 576 -51 59 -134 -607 -684 280 -572 127 -20 -251 -537 889 -268 820 785 601 583 1307 323 234 394 -609 112 -137 -409 -521 291 1293 61 165 -140 -674 -1141 SS 20210220T094837.0Z 7721.408761 203 1 17.98 2 68.02 150.76 90.86 53.37 0.00 1 0.00 1 0 25 1.732e-02 5.188e-03 9.374e-03 1.578e-03 3.574576e-01 8.073811e-04 4.760396e-03 -6.000000e+00 1.015850e-02 223.77 -2.00 3.88 -2.00 318.24 0.00e+00 4.966249e-04 1.411859e-04 1.253167e-04 -6.000000e+00 4.149584e-04 266.35 -2.00 20.00 -2.00 317.94 0.00e+00 2.649 0.000 302.00 328.00 3 3.1788e+00 2.1448e-03 3.2957e-02 -6.0000e+00 2.5181e-02 3.9066e-02 2.4165e-03 2.0017e-02 -6.0000e+00 2.7451e-02 -1.0678e-02 1.6562e-03 1.0151e-02 -6.0000e+00 1.6185e-02 -9.2932e-04 8.7390e-04 3.0043e-03 -6.0000e+00 6.7635e-03 1.0296e-03 -5.3813e-04 4.8775e-05 3.6889e-05 -6.0000e+00 5.1963e-04 2.2620e-03 -4.0010e-06 12 1 1 12 1 1 99.60 22.25 0.22 0.00226 -0.00178 37 21 1 5 0 468.479 25.28 20.00 22.25 16.67 23.0 1035.42 945 -10223 1297 -6564 1912 -7978 -1003 270 -2906 746 -5701 1793 -6361 69 -4597 187 -2180 71 1082 -390 1250 -709 2785 -1965 1443 -1915 -658 -934 1171 -780 144 2313 -578 275 -1403 -1267 -1119 -1281 -447 -1437 -459 -1191 -506 -1253 385 -765 417 -1016 -366 332 687 1202 454 860 539 1107 193 217 492 1125 1953 1229 1628 116 274 150 400 608 511 743 74 512 -161 2 -109 196 -161 526 151 -237 -511 -1348 -1154 -1358 -886 -1299 -394 -440 111 -100 337 507 578 1027 501 702 516 443 -433 -437 -376 -566 266 17 -713 -654 -465 -497 161 -65 26 -48 -72 39 -70 692 424 459 -41 -329 -529 -43 -57 64 401 148 970 883 595 509 175 36 180 290 -93 -59 173 96 -479 -88 -417 -299 -281 45 -605 71 -370 91 -407 -51 15 -186 49 -409 127 -558 7 -542 24 -286 10 153 -58 187 -109 425 -334 252 -360 -122 -167 208 -142 26 459 -129 63 -318 -285 -271 -363 -150 -539 -189 -524 -229 -581 176 -355 190 -466 -167 154 336 600 245 490 320 674 121 136 302 682 1206 780 1123 87 209 110 277 414 370 572 63 455 -145 2 -88 149 -112 369 106 -187 -437 -1237 -1144 -1429 -946 -1487 -453 -523 132 -115 378 545 577 995 513 760 601 573 -583 -592 -484 -699 319 20 -883 -860 -617 -693 228 -99 40 -77 -115 59 -103 980 591 659 -60 -495 -819 -65 -88 94 567 208 1295 1174 840 749 276 57 294 477 -161 -104 317 179 -876 -162 -746 -530 -482 SS 20210220T095426.4Z 7721.412805 206 1 48.77 2 67.60 152.23 90.16 54.49 0.00 1 0.00 1 0 25 1.896e-02 4.644e-03 1.138e-02 1.607e-03 3.518919e-01 8.220475e-04 4.674179e-03 -6.000000e+00 1.111860e-02 223.77 -2.00 3.88 -2.00 318.72 0.00e+00 6.351861e-04 1.622312e-04 1.371198e-04 -6.000000e+00 4.541753e-04 266.35 -2.00 20.00 -2.00 318.42 0.00e+00 2.603 0.000 302.00 328.00 3 3.8104e+00 2.2015e-03 3.2434e-02 -6.0000e+00 2.7561e-02 4.2891e-02 2.4931e-03 1.9754e-02 -6.0000e+00 3.0046e-02 -7.6196e-03 1.7988e-03 1.0056e-02 -6.0000e+00 1.7715e-02 -1.7859e-03 9.5867e-04 3.0005e-03 -6.0000e+00 7.4028e-03 5.7420e-04 -5.1179e-04 5.0584e-05 3.7340e-05 -6.0000e+00 5.6874e-04 2.1324e-03 -7.2447e-06 12 1 1 12 1 1 99.94 22.25 0.12 0.00213 -0.00171 68 14 1 5 0 704.208 25.28 20.00 22.25 17.03 23.0 1037.33 -12830 -3280 -6554 -6374 -677 -4149 -5654 -3340 3519 -8352 1122 -3005 1591 -1668 -817 134 -1382 1392 -480 951 -1443 426 -1824 -1053 -478 -1503 -360 -949 289 -720 1288 1869 782 -1516 -1752 -1428 -1697 411 -1080 -789 -1501 -137 -1546 -7 -529 -177 -75 -652 -13 -235 1392 505 1309 46 467 1281 414 596 149 1252 614 1446 1312 736 394 409 408 421 1058 214 125 -283 228 -428 137 464 -87 369 287 -406 -876 -707 -1382 -919 -1259 -653 -482 -123 -98 85 521 116 908 819 909 558 628 264 -312 -308 -519 -255 -50 334 -1018 -724 -604 -274 -89 236 88 -198 -11 -134 167 277 385 353 93 -258 -541 124 -280 69 290 457 614 1033 482 250 234 -27 299 239 71 -220 88 85 -259 -183 -233 -268 -260 -575 -149 -316 -295 -28 -170 -248 -160 174 -489 62 -183 105 -132 -74 14 -152 157 -58 118 -187 55 -246 -149 -71 -236 -56 -143 41 -105 197 314 144 -297 -335 -270 -347 95 -301 -253 -535 -51 -603 -3 -209 -70 -30 -256 -5 -94 578 227 622 23 245 685 227 327 81 671 339 844 828 497 272 271 258 263 693 156 98 -233 188 -344 103 322 -56 228 185 -291 -703 -620 -1303 -906 -1311 -714 -552 -144 -115 98 565 118 864 763 882 590 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