File name: Pandora21s1_Bremen_20200715_L2Fit_fout2c14d20191026p1-8.txt File generation date: 20250507T104851.7Z 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_20200715_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: 20200715 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 20200715T064818.5Z 7501.283547 281 1 8.98 2 61.47 91.79 39.65 175.88 0.00 1 0.00 1 0 25 1.181e-02 5.731e-03 3.345e-03 8.597e-04 3.334221e-01 4.561416e-04 4.375585e-03 -6.000000e+00 7.167220e-03 234.07 -2.00 3.88 -2.00 317.59 0.00e+00 -6.468384e-05 6.404743e-05 8.946987e-05 -6.000000e+00 2.825268e-04 282.77 -2.00 20.00 -2.00 317.26 0.00e+00 2.083 0.000 302.00 328.00 3 2.2641e+00 1.2219e-03 2.8787e-02 -6.0000e+00 1.8202e-02 5.7514e-03 1.3587e-03 1.9389e-02 -6.0000e+00 1.9715e-02 -1.2351e-03 8.4395e-04 9.4717e-03 -6.0000e+00 1.1531e-02 -2.0529e-03 4.1936e-04 2.6276e-03 -6.0000e+00 4.7065e-03 4.4827e-03 -4.4222e-04 2.6574e-05 3.2207e-05 -6.0000e+00 3.5567e-04 -1.8089e-03 0.0000e+00 12 1 1 12 1 1 99.38 22.46 0.17 -0.00181 -0.00513 90 101 1 5 0 96.729 25.39 20.00 22.46 23.12 18.4 1007.78 -2487 -3039 -6635 -5618 -4325 -3324 -284 -1050 -263 -2780 -1708 -1044 851 409 -310 38 -366 347 434 357 -361 417 514 303 644 -595 -934 -944 358 831 1796 1513 463 -736 -397 15 -30 1033 12 -512 -610 -542 -916 -607 -622 -1076 -792 -846 -282 530 734 752 810 555 361 430 388 445 745 1058 1275 1530 827 150 -254 68 181 948 860 267 -204 -440 -615 -460 -248 -132 359 799 723 210 -576 -1147 -1270 -1275 -1006 -919 -626 -405 -180 41 615 650 1480 1581 1251 790 581 99 -340 -547 -451 -184 368 54 -824 -611 -677 -462 -141 -161 -177 -335 -138 -16 463 711 634 429 -200 -515 -507 -269 -301 167 395 556 1188 1030 604 278 167 194 270 345 -83 -113 -7 -174 -410 -239 -341 -158 -184 -202 -268 -609 -479 -338 -256 -23 -97 -26 -299 -186 -122 104 58 -51 7 -70 69 91 77 -80 93 119 70 156 -151 -234 -241 87 203 469 407 136 -221 -115 4 -10 389 5 -238 -310 -289 -505 -337 -346 -600 -435 -460 -152 291 428 446 512 371 238 291 267 305 501 709 883 1138 639 124 -210 53 141 727 675 235 -187 -421 -589 -422 -221 -107 278 597 572 178 -529 -1117 -1329 -1352 -1135 -1060 -759 -484 -222 49 708 688 1511 1584 1331 893 703 127 -448 -719 -581 -228 430 64 -1017 -799 -895 -640 -199 -242 -272 -525 -212 -24 664 959 849 597 -287 -781 -758 -398 -449 239 558 746 1581 1376 826 396 252 293 419 559 -137 -190 -12 -309 -709 -418 -574 -265 -300 SS 20200715T065304.6Z 7501.286859 284 1 11.20 2 60.75 92.76 39.60 177.66 0.00 1 0.00 1 0 25 1.859e-02 6.019e-03 7.806e-03 1.934e-03 3.280144e-01 1.024412e-03 4.303984e-03 -6.000000e+00 1.128149e-02 234.07 -2.00 3.88 -2.00 317.62 0.00e+00 1.274647e-04 1.450873e-04 8.979064e-05 -6.000000e+00 4.447676e-04 282.77 -2.00 20.00 -2.00 317.29 0.00e+00 2.037 0.000 302.00 328.00 3 4.0401e+00 2.7445e-03 2.8242e-02 -6.0000e+00 2.8651e-02 2.0927e-02 3.0519e-03 1.9087e-02 -6.0000e+00 3.1033e-02 2.0440e-04 1.9054e-03 9.3273e-03 -6.0000e+00 1.8150e-02 -2.3699e-03 9.5102e-04 2.5869e-03 -6.0000e+00 7.4076e-03 7.9181e-04 -3.9718e-04 5.9825e-05 3.1575e-05 -6.0000e+00 5.5991e-04 -1.0305e-03 0.0000e+00 12 1 1 12 1 1 95.94 22.46 0.24 -0.00103 -0.00402 16 15 1 5 0 648.388 25.39 20.00 22.46 23.52 18.5 1009.62 6428 -6626 2284 -8384 238 -4213 -4704 2002 -4132 571 -6891 6675 -3647 2532 -2366 1208 -1667 -2443 -9 -2563 1585 -2292 3244 -2434 570 -691 66 -715 -1450 3427 231 4354 -1190 -659 -1594 1508 -14 1406 249 -1300 -119 -1426 -995 -1702 -115 -790 159 -517 -435 408 327 1834 484 1314 222 1461 284 732 476 796 1399 898 1538 65 228 -14 44 831 817 263 -233 -15 -558 -67 -447 109 -505 925 383 -329 -116 -1243 -978 -1567 -559 -1040 -412 -482 7 71 166 979 468 1104 466 662 437 86 -349 -414 -773 -769 481 -303 -724 -925 -528 -437 277 -26 78 21 -26 336 265 971 322 391 -183 -406 -490 -398 203 113 505 453 1285 788 613 274 424 79 -1 295 -284 73 31 -144 -463 -52 -362 -300 -302 465 -580 185 -707 17 -320 -388 173 -412 57 -752 690 -469 353 -390 210 -314 -485 -2 -548 333 -502 701 -583 140 -176 16 -173 -342 786 58 1149 -351 -196 -464 433 -4 505 104 -617 -60 -755 -537 -932 -62 -431 85 -276 -232 221 186 1090 305 856 149 996 198 507 327 546 981 666 1204 53 187 -11 33 628 651 228 -214 -14 -525 -61 -390 89 -388 690 298 -279 -106 -1229 -1012 -1689 -624 -1215 -496 -591 9 84 189 1053 482 1119 492 745 528 111 -467 -552 -997 -944 569 -365 -910 -1207 -709 -604 395 -38 119 33 -40 495 374 1319 437 542 -264 -607 -743 -600 300 163 708 617 1699 1047 845 396 634 121 -2 470 -467 123 54 -251 -812 -90 -614 -498 -494 SS 20200715T065819.7Z 7501.290506 287 1 3.49 2 59.97 93.83 39.56 179.63 0.00 1 0.00 1 0 25 1.064e-02 5.374e-03 3.349e-03 1.077e-03 3.185137e-01 5.721760e-04 4.190300e-03 -6.000000e+00 6.460470e-03 234.07 -2.00 3.88 -2.00 317.16 0.00e+00 2.141917e-04 7.165668e-05 7.425300e-05 -6.000000e+00 2.546853e-04 282.77 -2.00 20.00 -2.00 316.83 0.00e+00 1.989 0.000 302.00 328.00 3 1.9224e+00 1.5232e-03 2.7473e-02 -6.0000e+00 1.6407e-02 5.7730e-03 1.6913e-03 1.8487e-02 -6.0000e+00 1.7771e-02 -1.4047e-03 1.0172e-03 9.0135e-03 -6.0000e+00 1.0394e-02 -1.1180e-03 4.9128e-04 2.4887e-03 -6.0000e+00 4.2422e-03 7.0583e-03 -4.9880e-04 3.3164e-05 3.1122e-05 -6.0000e+00 3.2062e-04 -1.4192e-03 0.0000e+00 12 1 1 12 1 1 95.76 22.47 0.20 -0.00142 -0.00517 47 142 1 5 0 69.093 25.39 20.00 22.47 23.88 18.4 1011.05 400 -3039 -3576 -6443 -4108 -3062 894 -592 -1367 -1709 -1943 939 -341 210 -545 169 -678 -154 320 -246 213 139 1652 -225 240 -671 -1253 -829 397 1342 1361 1803 -640 -1318 -1085 50 -86 538 340 -374 -710 -739 -621 -750 -522 -755 -701 -616 3 615 858 997 937 595 740 728 615 647 765 736 1188 1377 1311 248 -40 2 28 662 919 232 -190 -369 -473 -218 -361 -328 99 540 333 -348 -439 -1117 -1235 -1170 -1059 -936 -492 -430 -82 -308 232 217 756 1068 796 750 592 154 -353 -411 -323 -314 367 -14 -708 -729 -536 -400 131 -51 -74 -100 -71 128 517 704 463 426 -109 -446 -454 -196 -160 358 578 528 1240 750 496 320 323 154 241 251 -356 -160 -32 -267 -456 -218 -289 -119 -206 42 -352 -418 -725 -418 -307 93 -70 -179 -234 -272 137 -54 38 -113 38 -164 -36 78 -63 55 36 439 -64 73 -210 -389 -244 111 375 409 591 -216 -454 -384 18 -32 231 164 -197 -410 -424 -366 -447 -311 -451 -413 -357 2 360 531 662 630 422 543 523 449 470 547 527 877 1091 1076 217 -35 2 23 535 760 206 -177 -358 -458 -202 -325 -280 81 423 276 -311 -423 -1144 -1304 -1257 -1212 -1100 -585 -526 -100 -376 262 233 781 1080 852 853 723 194 -473 -548 -407 -378 433 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