File name: Pandora133s1_Heidelberg_20240721_L2Fit_fout2c3d20240611p1-8.txt File generation date: 20240930T104044.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Andre Butz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 133 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora133_OF_v1d20240405.txt Instrument calibration file used: Pandora133s1_CF_v3d20240611.txt Level 1 file used: Pandora133s1_Heidelberg_20240721_L1_smca1c3d20240611p1-8.txt Full location name: Institute of Environmental Physics, Heidelberg University Short location name: Heidelberg Country of location: Germany Location latitude [deg]: 49.4173 Location longitude [deg]: 8.6746 Location altitude [m]: 144 Local noon date: 20240721 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 227 368 Nominal wavelengths inside fitting window [nm]: 305.0728 305.2141 305.3553 305.4966 305.6378 305.7790 305.9202 306.0614 306.2026 306.3438 306.4849 306.6261 306.7672 306.9083 307.0494 307.1905 307.3316 307.4727 307.6138 307.7548 307.8959 308.0369 308.1779 308.3189 308.4599 308.6009 308.7418 308.8828 309.0238 309.1647 309.3056 309.4465 309.5874 309.7283 309.8692 310.0100 310.1509 310.2917 310.4326 310.5734 310.7142 310.8550 310.9958 311.1365 311.2773 311.4180 311.5588 311.6995 311.8402 311.9809 312.1216 312.2623 312.4029 312.5436 312.6842 312.8249 312.9655 313.1061 313.2467 313.3872 313.5278 313.6684 313.8089 313.9494 314.0900 314.2305 314.3710 314.5115 314.6519 314.7924 314.9328 315.0733 315.2137 315.3541 315.4945 315.6349 315.7753 315.9157 316.0560 316.1964 316.3367 316.4770 316.6173 316.7576 316.8979 317.0382 317.1784 317.3187 317.4589 317.5991 317.7393 317.8795 318.0197 318.1599 318.3001 318.4402 318.5804 318.7205 318.8606 319.0007 319.1408 319.2809 319.4209 319.5610 319.7010 319.8411 319.9811 320.1211 320.2611 320.4011 320.5410 320.6810 320.8209 320.9609 321.1008 321.2407 321.3806 321.5205 321.6604 321.8002 321.9401 322.0799 322.2198 322.3596 322.4994 322.6392 322.7789 322.9187 323.0585 323.1982 323.3379 323.4776 323.6173 323.7570 323.8967 324.0364 324.1760 324.3157 324.4553 324.5949 324.7346 324.8741 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-384: 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 20240721T074259.8Z 8968.321525 198 1 51.73 2 53.53 101.45 131.12 277.44 0.00 1 0.00 1 0 17 1.076e-02 7.192e-03 4.313e-04 1.680e-04 2.390224e-01 8.711543e-05 2.978269e-03 -6.000000e+00 6.333305e-03 233.37 -2.00 3.74 -2.00 316.89 0.00e+00 6.341817e-04 1.106996e-05 1.221170e-04 -6.000000e+00 2.738076e-04 283.78 -2.00 20.00 -2.00 316.14 0.00e+00 1.678 0.000 302.00 328.00 3 9.4154e-01 2.3059e-04 2.1357e-02 -6.0000e+00 1.5946e-02 -1.9507e-02 2.5707e-04 1.3246e-02 -6.0000e+00 1.7207e-02 -6.5258e-04 1.5098e-04 6.4014e-03 -6.0000e+00 1.0206e-02 -3.2725e-03 7.2168e-05 1.8282e-03 -6.0000e+00 4.3287e-03 3.0109e-02 2.2382e-03 4.8766e-06 1.9711e-05 -6.0000e+00 2.9436e-04 2.5074e-02 0.0000e+00 11 8 0 10 0 0 99.89 24.03 0.19 0.02507 0.04189 2860 760 2 8 0 16.570 20.01 24.03 31.01 27.56 27.88 1.4 938.57 -772 463 -352 -2120 -3119 -2912 -1711 -768 -462 -1928 -2933 -2253 -2035 -525 266 75 473 850 1126 1546 377 1087 856 414 271 1068 135 -489 -612 481 285 1269 742 -2294 -3158 -2951 -3136 -1524 -896 -635 -811 -121 -362 3 225 210 -156 -180 -799 519 477 690 1052 831 789 1138 611 553 250 619 942 1559 2046 1735 -17 224 -953 -294 685 444 498 661 598 673 -46 -567 -1682 -1404 -1313 -1650 -1409 -1880 -2167 -1097 -614 -111 189 844 785 611 561 -325 -502 -63 -213 62 864 571 -107 -209 -955 -1391 -460 -378 -1175 -704 -686 -308 504 764 688 214 120 -419 -190 89 60 525 668 -40 152 389 391 371 439 -487 760 835 280 199 -259 -327 -194 334 233 -54 622 176 -281 -310 -511 -981 -109 69 -52 -288 -423 -396 -250 -113 -74 -320 -483 -393 -402 -116 66 20 129 241 329 465 115 328 270 138 94 378 47 -157 -187 148 94 446 281 -872 -1129 -1096 -1321 -684 -478 -353 -478 -74 -225 2 139 129 -93 -105 -499 329 299 457 731 606 586 858 467 417 187 467 748 1237 1740 1523 -14 186 -762 -237 564 410 490 661 586 623 -39 -467 -1294 -1076 -1105 -1458 -1380 -1873 -2270 -1208 -726 -129 230 1037 945 735 617 -352 -511 -65 -225 72 1044 749 -142 -264 -1203 -1640 -538 -476 -1499 -934 -955 -421 724 1158 1071 326 171 -588 -247 113 78 729 939 -59 222 558 574 515 580 -658 998 1153 389 293 -396 -478 -291 528 391 -89 1038 299 -471 -503 -852 -1598 SS 20240721T081139.7Z 8968.341431 202 1 51.72 2 49.02 107.84 135.42 283.48 0.00 1 0.00 1 0 25 1.014e-02 7.185e-03 2.885e-04 1.345e-04 2.185441e-01 6.991894e-05 2.728026e-03 -6.000000e+00 5.973333e-03 233.37 -2.00 3.74 -2.00 316.40 0.00e+00 5.114835e-04 7.949472e-06 9.125169e-05 -6.000000e+00 2.581645e-04 283.78 -2.00 20.00 -2.00 315.67 0.00e+00 1.522 0.000 302.00 328.00 3 7.3681e-01 1.8396e-04 1.9433e-02 -6.0000e+00 1.5040e-02 -1.6184e-02 2.0469e-04 1.2102e-02 -6.0000e+00 1.6228e-02 1.5868e-05 1.1842e-04 5.8447e-03 -6.0000e+00 9.6245e-03 -3.5723e-03 5.4941e-05 1.6484e-03 -6.0000e+00 4.0840e-03 4.4446e-02 2.4158e-03 3.8831e-06 1.8533e-05 -6.0000e+00 2.7751e-04 2.2592e-02 0.0000e+00 11 8 0 10 0 0 93.78 24.12 0.18 0.02259 0.04074 3198 850 2 8 0 14.820 20.02 24.12 33.47 27.67 27.99 1.3 952.75 -784 616 -226 -2034 -2946 -2342 -1562 -331 -127 -1476 -2499 -1841 -1846 -407 235 183 419 795 1163 1567 400 1174 907 705 377 1161 236 -228 -383 621 309 1291 659 -2172 -3065 -2800 -2999 -1443 -817 -599 -790 -94 -381 -48 167 145 -212 -188 -802 533 438 636 941 795 768 1121 576 536 240 621 906 1476 1950 1634 -53 198 -984 -307 692 379 441 599 571 665 -26 -489 -1561 -1321 -1228 -1627 -1445 -1878 -2180 -1121 -632 -159 175 805 745 579 509 -335 -461 -20 -208 43 854 578 -80 -217 -933 -1356 -433 -355 -1175 -698 -662 -337 498 760 704 211 129 -403 -181 93 61 527 694 -8 142 381 378 341 460 -450 748 845 315 220 -245 -329 -147 360 251 -67 615 164 -287 -337 -524 -1014 -146 120 -44 -361 -473 -374 -269 -63 -26 -315 -526 -407 -461 -113 73 61 142 278 384 531 137 398 321 262 146 458 91 -81 -141 230 122 493 271 -892 -1182 -1118 -1356 -758 -469 -388 -504 -61 -256 -32 111 103 -146 -126 -529 355 312 443 688 607 597 884 460 422 187 489 751 1227 1733 1496 -46 169 -807 -252 626 360 444 615 574 632 -23 -411 -1222 -1024 -1043 -1456 -1431 -1896 -2312 -1250 -712 -188 216 1006 913 664 567 -366 -470 -20 -219 50 1031 756 -105 -273 -1169 -1591 -503 -446 -1500 -927 -870 -462 714 1147 1031 319 182 -557 -232 116 78 720 962 -12 207 541 548 468 599 -596 962 1139 428 314 -364 -470 -215 555 388 -108 1003 273 -471 -536 -854 -1616 SS 20240721T081652.3Z 8968.345049 204 1 51.73 2 48.22 109.07 136.19 284.64 0.00 1 0.00 1 0 25 1.010e-02 7.210e-03 2.710e-04 1.282e-04 2.154246e-01 6.676222e-05 2.686151e-03 -6.000000e+00 5.948980e-03 233.37 -2.00 3.74 -2.00 316.35 0.00e+00 4.772272e-04 7.489273e-06 9.287787e-05 -6.000000e+00 2.570127e-04 283.78 -2.00 20.00 -2.00 315.62 0.00e+00 1.498 0.000 302.00 328.00 3 6.6146e-01 1.7578e-04 1.9133e-02 -6.0000e+00 1.4979e-02 -1.5815e-02 1.9549e-04 1.1913e-02 -6.0000e+00 1.6159e-02 2.6597e-04 1.1278e-04 5.7520e-03 -6.0000e+00 9.5841e-03 -3.6589e-03 5.2238e-05 1.6218e-03 -6.0000e+00 4.0688e-03 4.9311e-02 2.7669e-03 3.7065e-06 1.8177e-05 -6.0000e+00 2.7622e-04 1.9870e-02 0.0000e+00 11 8 0 10 0 0 39.12 24.15 0.18 0.01987 0.04066 3660 973 2 8 0 12.950 20.01 24.15 33.86 27.67 27.99 1.3 956.55 -727 525 -263 -2065 -3018 -2369 -1434 -326 6 -1472 -2472 -1735 -1810 -438 226 113 487 829 1120 1466 367 1064 940 669 418 1206 206 -237 -313 599 377 1247 698 -2158 -3044 -2857 -2957 -1442 -808 -579 -782 -119 -353 -71 167 126 -242 -158 -758 495 451 632 974 795 749 1120 588 557 298 601 919 1500 1996 1622 -73 199 -966 -300 741 402 459 628 551 650 -24 -516 -1598 -1337 -1210 -1617 -1406 -1868 -2147 -1117 -623 -169 170 817 729 554 487 -341 -456 19 -185 88 889 565 -76 -228 -907 -1353 -441 -329 -1181 -699 -668 -331 517 744 712 209 137 -388 -201 86 59 568 683 -11 137 349 373 343 455 -450 745 845 311 217 -251 -332 -161 365 256 -61 615 145 -295 -325 -531 -1003 -138 104 -52 -374 -495 -386 -251 -63 1 -320 -530 -390 -459 -124 71 38 167 293 374 503 127 398 336 251 164 480 81 -93 -116 223 149 479 288 -890 -1178 -1146 -1341 -760 -466 -377 -539 -78 -237 -47 111 89 -167 -106 -500 330 320 440 711 606 581 881 469 438 231 472 759 1331 1767 1479 -63 169 -788 -245 665 379 460 640 550 615 -22 -431 -1243 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