File name: Pandora272s1_Lauder_20260213_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20260213T130114.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v2d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260213_L1_smca1c2d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20260213 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: OoB based on session 1 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0435 305.1840 305.3244 305.4648 305.6052 305.7456 305.8860 306.0263 306.1667 306.3070 306.4473 306.5877 306.7280 306.8683 307.0086 307.1488 307.2891 307.4293 307.5696 307.7098 307.8500 307.9902 308.1304 308.2706 308.4108 308.5510 308.6911 308.8313 308.9714 309.1115 309.2516 309.3917 309.5318 309.6719 309.8119 309.9520 310.0920 310.2321 310.3721 310.5121 310.6521 310.7921 310.9320 311.0720 311.2120 311.3519 311.4918 311.6317 311.7717 311.9115 312.0514 312.1913 312.3312 312.4710 312.6109 312.7507 312.8905 313.0303 313.1701 313.3099 313.4496 313.5894 313.7292 313.8689 314.0086 314.1483 314.2880 314.4277 314.5674 314.7071 314.8467 314.9864 315.1260 315.2656 315.4052 315.5448 315.6844 315.8240 315.9636 316.1031 316.2427 316.3822 316.5217 316.6612 316.8007 316.9402 317.0797 317.2192 317.3586 317.4981 317.6375 317.7769 317.9163 318.0557 318.1951 318.3345 318.4738 318.6132 318.7525 318.8918 319.0312 319.1705 319.3097 319.4490 319.5883 319.7276 319.8668 320.0060 320.1453 320.2845 320.4237 320.5629 320.7020 320.8412 320.9804 321.1195 321.2586 321.3977 321.5368 321.6759 321.8150 321.9541 322.0932 322.2322 322.3713 322.5103 322.6493 322.7883 322.9273 323.0663 323.2052 323.3442 323.4831 323.6221 323.7610 323.8999 324.0388 324.1777 324.3166 324.4554 324.5943 324.7331 324.8719 --------------------------------------------------------------------------------------- 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 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20260212T202802.5Z 9539.852807 563 1 6.09 2 64.22 83.25 19.09 30.94 0.00 1 0.00 1 0 17 2.459e-02 7.805e-03 2.038e-02 3.950e-03 2.635338e-01 2.028455e-03 3.304148e-03 -6.000000e+00 1.435811e-02 230.91 -2.00 3.69 -2.00 318.45 0.00e+00 7.953718e-04 3.879126e-04 8.297442e-05 -6.000000e+00 6.166580e-04 279.57 -2.00 20.00 -2.00 317.77 0.00e+00 2.285 0.000 302.00 328.00 3 2.9902e+00 5.5128e-03 2.6250e-02 -6.0000e+00 3.5985e-02 2.7934e-03 6.2338e-03 1.4644e-02 -6.0000e+00 3.8897e-02 1.9560e-02 4.0987e-03 7.1579e-03 -6.0000e+00 2.3065e-02 -1.1801e-02 2.1055e-03 2.1355e-03 -6.0000e+00 9.8012e-03 2.2059e-03 -1.3211e-04 1.1895e-04 2.3530e-05 -6.0000e+00 6.7644e-04 1.6693e-02 2.1028e-05 11 8 0 10 0 0 84.53 25.42 0.13 0.01669 0.01570 2529 2004 3 8 0 2.400 20.01 25.42 27.27 35.25 33.75 0.7 993.26 1150 265 -6563 3338 4741 -8647 -15155 -7324 -3328 -3192 -9165 -1431 782 1013 2255 473 -477 1839 5475 2975 2768 -84 324 -4030 -1585 -740 -1170 1664 -1665 -3181 -2445 -1455 3542 3610 -5909 -2891 1076 -301 1687 425 -1405 -2089 70 747 -240 -1427 151 -2289 -1088 2597 1336 684 -404 546 -1382 600 2035 -349 1365 931 3928 597 1565 1011 378 -671 478 -199 -861 837 459 912 -35 1174 359 682 -280 -2319 -1605 -216 -989 -2245 -2027 -2355 -724 -830 -1223 335 1116 478 589 383 1203 -475 33 166 99 941 840 624 156 -900 -1227 -1050 -386 -1286 -428 -95 -123 555 350 771 152 427 -519 -163 -760 35 78 100 -515 64 223 -211 741 93 -557 742 677 466 309 -582 -132 132 -451 880 -477 734 404 -517 -147 23 -799 70 18 -487 212 264 -530 -1051 -521 -253 -257 -780 -116 70 103 260 62 -66 259 776 449 427 -13 52 -717 -288 -139 -222 291 -280 -536 -434 -275 691 735 -1248 -633 246 -80 527 144 -537 -843 29 309 -110 -663 68 -1033 -476 1095 600 331 -209 296 -796 345 1177 -207 783 532 2232 374 1057 737 281 -470 307 -125 -563 604 369 771 -30 972 281 482 -180 -1427 -998 -147 -767 -1959 -1908 -2330 -751 -929 -1452 407 1366 575 658 393 1122 -425 31 167 110 1163 1124 838 200 -1086 -1378 -1173 -464 -1666 -574 -134 -181 861 580 1309 254 670 -757 -220 -1004 47 112 155 -832 102 350 -322 1060 127 -731 938 900 666 468 -928 -213 218 -793 1620 -920 1433 807 -1028 -280 43 -1441 SS 20260212T203220.5Z 9539.855793 566 1 36.60 2 63.47 82.44 18.73 28.31 0.00 1 0.00 1 0 17 1.037e-02 6.854e-03 7.060e-04 3.664e-04 2.627584e-01 1.900505e-04 3.305017e-03 -6.000000e+00 6.053813e-03 230.91 -2.00 3.69 -2.00 316.07 0.00e+00 5.194245e-04 1.979794e-05 7.447007e-05 -6.000000e+00 2.598687e-04 279.57 -2.00 20.00 -2.00 315.44 0.00e+00 2.226 0.000 302.00 328.00 3 1.7606e+00 4.9503e-04 2.5637e-02 -6.0000e+00 1.5173e-02 2.5596e-02 5.4958e-04 1.4303e-02 -6.0000e+00 1.6398e-02 -5.5682e-03 3.1750e-04 6.9534e-03 -6.0000e+00 9.7238e-03 1.7577e-04 1.4665e-04 1.9522e-03 -6.0000e+00 4.1336e-03 7.9558e-03 1.5129e-04 1.0429e-05 2.3268e-05 -6.0000e+00 2.8506e-04 1.5874e-02 1.0055e-04 12 9 1 12 1 1 99.98 25.42 0.32 0.01587 0.01701 492 76 2 8 0 74.220 20.00 25.42 27.63 35.25 33.75 0.7 995.92 -766 -756 -1020 -2469 -3234 -3344 -2159 -1781 -341 -1933 -3022 -2284 -1382 -327 743 594 136 732 943 1458 1244 921 1431 929 619 1024 196 -316 -425 420 788 1090 1654 79 -2811 -2307 -2537 -1461 -134 -118 -587 -244 -443 559 -222 -32 -323 -370 -825 -420 588 708 961 1254 865 807 899 460 229 276 739 1159 1563 1886 871 -72 -323 -781 -58 642 461 555 321 468 207 -295 -680 -1424 -1222 -907 -1164 -1249 -1842 -2526 -1202 -716 -240 202 545 562 351 227 -333 -400 -91 15 359 898 573 195 -57 -846 -1487 -572 -408 -729 -507 -426 -354 298 573 648 457 318 -109 -92 -73 46 271 507 153 409 547 444 566 576 86 385 440 228 256 27 -245 -313 -13 -21 -102 337 163 -130 -226 -554 -949 -161 -161 -224 -517 -656 -651 -439 -400 -77 -473 -743 -570 -382 -95 244 202 49 271 362 541 472 348 550 379 265 453 83 -135 -169 163 322 476 731 37 -1278 -1010 -1208 -747 -76 -76 -397 -165 -309 392 -157 -23 -225 -250 -577 -292 405 522 715 983 678 644 731 376 184 220 600 960 1345 1737 791 -64 -278 -651 -49 588 453 554 325 460 199 -267 -579 -1190 -1035 -817 -1098 -1263 -1956 -2733 -1368 -845 -288 243 666 691 415 254 -355 -418 -98 16 421 1096 737 252 -72 -1040 -1761 -668 -500 -926 -652 -576 -488 419 830 942 670 452 -147 -119 -94 59 370 702 222 589 772 624 773 749 110 495 576 310 358 38 -356 -454 -19 -33 -162 534 264 -208 -358 -873 -1454 SS 20260212T203640.2Z 9539.858798 568 1 25.97 2 62.71 81.62 18.39 25.58 0.00 1 0.00 1 0 17 9.756e-03 6.803e-03 4.203e-04 2.312e-04 2.566759e-01 1.199104e-04 3.233136e-03 -6.000000e+00 5.698399e-03 230.91 -2.00 3.69 -2.00 315.88 0.00e+00 5.147889e-04 1.199003e-05 6.178326e-05 -6.000000e+00 2.446036e-04 279.57 -2.00 20.00 -2.00 315.27 0.00e+00 2.169 0.000 302.00 328.00 3 5.8142e-01 3.1168e-04 2.5003e-02 -6.0000e+00 1.4282e-02 2.0339e-02 3.4598e-04 1.3964e-02 -6.0000e+00 1.5436e-02 -4.7242e-03 1.9914e-04 6.7859e-03 -6.0000e+00 9.1529e-03 -5.6180e-04 9.1183e-05 1.9056e-03 -6.0000e+00 3.8910e-03 2.7600e-02 1.8919e-04 6.5650e-06 2.3142e-05 -6.0000e+00 2.6831e-04 1.5781e-02 1.0696e-04 12 9 1 12 1 1 99.99 25.42 0.32 0.01578 0.01720 1005 218 2 8 0 25.810 19.99 25.42 28.22 35.25 34.00 0.7 999.56 -480 -472 -696 -2562 -3479 -2824 -1607 -851 -102 -1186 -2639 -2011 -1226 -521 754 349 249 693 1036 1288 1319 814 1337 931 740 869 308 -408 -625 252 738 1171 1535 19 -2532 -2287 -2383 -1594 -349 -150 -565 -490 -372 617 -185 -59 -290 -471 -807 -385 532 686 959 1185 793 783 815 436 266 315 706 1082 1540 1792 798 -83 -329 -859 -85 628 581 655 366 505 208 -234 -672 -1359 -1120 -1018 -1200 -1224 -1825 -2511 -1169 -720 -259 241 592 555 375 192 -274 -340 -40 88 404 945 622 156 -46 -852 -1439 -662 -494 -754 -596 -442 -317 303 597 650 408 292 -135 -161 -48 71 217 485 150 386 529 455 532 597 134 413 436 210 262 22 -232 -273 12 -16 -144 349 130 -128 -241 -522 -910 -110 -110 -167 -588 -771 -596 -354 -206 -25 -315 -706 -545 -344 -166 253 130 92 263 408 524 547 337 562 392 327 397 143 -180 -271 107 309 523 739 9 -1181 -1087 -1166 -844 -207 -96 -384 -348 -262 436 -131 -42 -203 -335 -564 -268 384 508 719 937 630 633 671 361 217 254 581 912 1353 1629 741 -75 -286 -726 -73 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