File name: Pandora21s1_Bremen_20200827_L2Fit_fout2c14d20191026p1-8.txt File generation date: 20250507T104735.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c14p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v14d20191026.txt Level 1 file used: Pandora21s1_Bremen_20200827_L1_smca1c14d20191026p1-8.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: 20200827 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]: 305.1120 305.2523 305.3926 305.5329 305.6731 305.8134 305.9537 306.0939 306.2341 306.3744 306.5146 306.6548 306.7950 306.9352 307.0753 307.2155 307.3557 307.4958 307.6359 307.7761 307.9162 308.0563 308.1964 308.3364 308.4765 308.6166 308.7566 308.8966 309.0367 309.1767 309.3167 309.4567 309.5967 309.7366 309.8766 310.0166 310.1565 310.2964 310.4363 310.5763 310.7162 310.8560 310.9959 311.1358 311.2756 311.4155 311.5553 311.6952 311.8350 311.9748 312.1146 312.2543 312.3941 312.5339 312.6736 312.8134 312.9531 313.0928 313.2325 313.3722 313.5119 313.6516 313.7913 313.9309 314.0706 314.2102 314.3498 314.4894 314.6290 314.7686 314.9082 315.0478 315.1873 315.3269 315.4664 315.6059 315.7455 315.8850 316.0245 316.1639 316.3034 316.4429 316.5823 316.7218 316.8612 317.0006 317.1400 317.2794 317.4188 317.5582 317.6976 317.8369 317.9763 318.1156 318.2549 318.3942 318.5335 318.6728 318.8121 318.9514 319.0906 319.2299 319.3691 319.5083 319.6475 319.7867 319.9259 320.0651 320.2043 320.3435 320.4826 320.6217 320.7609 320.9000 321.0391 321.1782 321.3173 321.4563 321.5954 321.7345 321.8735 322.0125 322.1515 322.2906 322.4296 322.5685 322.7075 322.8465 322.9854 323.1244 323.2633 323.4022 323.5411 323.6800 323.8189 323.9578 324.0967 324.2355 324.3744 324.5132 324.6520 324.7908 324.9296 --------------------------------------------------------------------------------------- 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 20200827T124916.6Z 7544.534220 12 1 17.28 2 46.43 208.85 109.33 104.78 0.00 1 0.00 1 0 25 8.070e-03 5.569e-03 1.350e-03 7.354e-04 1.985043e-01 3.897719e-04 2.669721e-03 -6.000000e+00 4.846989e-03 230.96 -2.00 3.88 -2.00 315.88 0.00e+00 2.057002e-04 3.622669e-05 2.920755e-05 -6.000000e+00 1.931050e-04 281.46 -2.00 20.00 -2.00 315.58 0.00e+00 1.449 0.000 302.00 328.00 3 3.3898e+00 1.0164e-03 1.8479e-02 -6.0000e+00 1.2216e-02 8.7127e-03 1.1271e-03 1.1410e-02 -6.0000e+00 1.3261e-02 4.3372e-03 6.4711e-04 5.5933e-03 -6.0000e+00 7.7750e-03 -2.7076e-03 2.8946e-04 1.5587e-03 -6.0000e+00 3.1957e-03 3.4209e-03 -1.6827e-04 2.2765e-05 2.1570e-05 -6.0000e+00 2.4290e-04 -5.4943e-03 0.0000e+00 12 1 1 12 1 1 99.96 22.15 0.17 -0.00549 -0.00676 111 64 1 5 0 152.758 25.17 20.00 22.15 27.24 21.2 1025.37 -761 -1931 -2956 -3896 -1992 -424 848 1320 62 -719 -349 601 354 690 202 -74 14 266 784 238 286 563 1126 550 352 -241 -843 -495 474 1315 1549 1768 443 -869 -838 -268 264 727 335 -553 -600 -1028 -1090 -1176 -773 -1055 -748 -1012 -246 549 699 949 875 830 595 546 393 344 743 1091 1148 1339 1097 99 -408 -90 -23 667 954 344 -162 -361 -436 -332 -325 66 211 749 456 -255 -570 -1290 -1359 -1047 -867 -783 -412 -368 -322 -83 142 210 762 1089 833 722 695 62 -400 -420 -315 -198 366 33 -593 -495 -541 -387 123 -133 -102 -49 -28 131 338 684 445 318 -62 -442 -532 -116 -73 297 464 544 1214 988 550 360 177 133 179 207 -166 -237 -39 -130 -372 -197 -282 -289 -251 -167 -453 -690 -911 -417 -86 180 310 16 -191 -92 163 98 214 70 -27 5 104 314 98 119 234 476 228 153 -107 -369 -217 194 524 641 777 207 -411 -379 -121 121 387 197 -374 -439 -741 -803 -871 -568 -769 -563 -740 -174 387 513 692 671 663 489 457 333 290 616 903 982 1152 1013 97 -392 -80 -20 562 850 323 -166 -365 -442 -342 -312 61 176 589 372 -231 -543 -1353 -1440 -1165 -975 -942 -521 -456 -399 -104 165 235 817 1119 890 796 802 78 -511 -532 -395 -230 429 40 -731 -647 -705 -525 174 -189 -151 -73 -40 183 436 865 556 413 -82 -625 -743 -161 -104 405 600 700 1481 1197 699 486 238 184 251 301 -242 -365 -60 -202 -585 -305 -443 -440 -374 SS 20200827T125451.9Z 7544.538101 15 1 49.88 2 46.85 210.66 108.56 105.79 0.00 1 0.00 1 0 17 8.684e-03 4.804e-03 7.259e-03 2.959e-03 2.076908e-01 1.552474e-03 2.777224e-03 -6.000000e+00 5.214885e-03 230.96 -2.00 3.88 -2.00 316.82 0.00e+00 4.110656e-04 1.783180e-04 4.079441e-05 -6.000000e+00 2.077872e-04 281.46 -2.00 20.00 -2.00 316.49 0.00e+00 1.460 0.000 302.00 328.00 3 6.3287e+00 4.0892e-03 1.8932e-02 -6.0000e+00 1.3143e-02 5.5952e-02 4.5500e-03 1.1954e-02 -6.0000e+00 1.4267e-02 4.3237e-03 2.6749e-03 5.8722e-03 -6.0000e+00 8.3654e-03 -5.2101e-03 1.2522e-03 1.6469e-03 -6.0000e+00 3.4380e-03 1.7223e-04 -2.1121e-04 9.2941e-05 2.1617e-05 -6.0000e+00 2.6137e-04 -4.7478e-03 0.0000e+00 10 0 0 10 0 0 99.91 22.21 0.35 -0.00475 -0.00633 24 5 1 5 0 2077.822 25.17 20.00 22.21 27.62 20.9 1027.10 -1507 -2549 120 -2201 -1639 -4416 1698 175 947 -1573 439 -457 -2834 -677 1462 1321 182 -443 577 909 -583 375 659 964 -303 800 -376 -326 795 364 1174 1577 1639 -1989 -773 -1489 -351 187 611 -588 -553 -74 -378 -330 -1238 -1041 -847 -717 -218 571 1038 443 491 750 864 911 417 -158 156 590 967 955 1180 398 -6 -281 -697 -368 692 257 976 -557 134 -107 236 -973 -798 -229 -762 -184 -803 -942 -1282 -561 -301 -66 -231 38 139 384 172 99 437 414 141 89 462 332 -52 167 100 -372 -98 125 -1375 -582 -718 75 360 540 339 97 44 -119 -111 103 -272 -713 -386 -260 -224 16 261 606 530 342 405 356 154 278 268 -201 401 248 73 140 483 -340 -213 -76 -359 -332 -277 -239 -430 20 -340 -232 -628 243 28 163 -285 78 -85 -596 -157 367 354 51 -129 171 276 -182 116 208 317 -105 280 -130 -107 245 111 370 527 575 -723 -267 -518 -132 81 307 -337 -340 -47 -246 -216 -815 -679 -541 -444 -132 345 649 294 341 539 635 681 316 -120 117 442 744 779 1020 359 -5 -236 -551 -284 558 228 923 -553 132 -102 213 -812 -611 -167 -576 -151 -729 -924 -1334 -606 -343 -80 -291 48 179 479 203 108 441 405 143 97 545 423 -70 220 126 -442 -112 146 -1724 -762 -978 105 523 816 530 153 67 -173 -151 132 -346 -940 -535 -379 -335 24 380 854 718 444 505 441 198 376 377 -289 583 371 114 227 804 -579 -365 -129 -595 -536 -440 SS 20200827T130009.2Z 7544.541773 18 1 50.39 2 47.26 212.35 107.83 106.74 0.00 1 0.00 1 0 17 1.299e-02 5.475e-03 8.873e-03 3.350e-03 2.098495e-01 1.753946e-03 2.802121e-03 -6.000000e+00 7.801772e-03 230.96 -2.00 3.88 -2.00 317.07 0.00e+00 9.183333e-05 2.128171e-04 4.336386e-05 -6.000000e+00 3.108714e-04 281.46 -2.00 20.00 -2.00 316.74 0.00e+00 1.471 0.000 302.00 328.00 3 6.1549e+00 4.6341e-03 1.9101e-02 -6.0000e+00 1.9662e-02 4.6460e-02 5.1604e-03 1.2077e-02 -6.0000e+00 2.1345e-02 7.3892e-03 3.0597e-03 5.9388e-03 -6.0000e+00 1.2515e-02 -7.3163e-03 1.4485e-03 1.6700e-03 -6.0000e+00 5.1433e-03 2.0273e-04 -7.2139e-05 1.0624e-04 2.1678e-05 -6.0000e+00 3.9103e-04 -4.5873e-03 0.0000e+00 10 0 0 10 0 0 99.98 22.25 0.38 -0.00459 -0.00513 76 15 1 5 0 662.982 25.28 20.00 22.25 27.99 20.8 1028.91 1768 -1939 -3960 2269 -5742 7347 -2458 2133 431 -2281 1846 -1816 506 -2674 2677 -1578 1788 1146 1146 -2074 -582 1646 -926 1739 -2062 1299 -1993 1052 -508 696 1030 1302 724 -885 116 -498 1231 -227 913 -368 -406 -740 -912 -850 -1404 185 -2086 -592 -1169 692 -426 236 1345 478 1210 704 615 -191 932 1007 999 728 759 586 -791 1116 39 996 518 870 105 44 209 -403 174 -656 -36 -783 558 -438 -466 -1254 -1227 -417 -964 -437 -344 381 -256 160 -9 307 361 -1 761 300 1038 218 -162 -373 -55 -716 -101 -481 -922 -456 -533 85 107 488 300 134 207 -174 -18 -109 -322 -364 232 -656 -74 37 253 230 520 915 559 608 27 315 -307 534 -3 240 -35 -474 366 2 215 -157 117 -712 -445 250 -299 -616 309 -778 866 -339 312 69 -386 300 -319 95 -583 614 -402 457 304 313 -600 -168 467 -275 528 -678 423 -655 318 -148 197 304 407 239 -298 37 -161 427 -93 432 -200 -237 -451 -568 -533 -882 114 -1281 -348 -678 397 -257 150 887 330 852 507 448 -139 667 722 740 575 638 513 -691 896 30 732 405 747 98 42 202 -379 152 -530 -26 -553 403 -350 -411 -1210 -1255 -444 -1093 -524 -433 490 -330 199 -11 330 358 -1 755 323 1212 278 -217 -496 -69 -850 -115 -562 -1150 -597 -728 120 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