File name: Pandora272s1_Lauder_20260219_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20260219T130315.2Z 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 v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v2d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260219_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: 20260219 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 20260218T233545.5Z 9545.983165 559 1 8.72 2 37.73 32.95 53.11 48.77 0.00 1 0.00 1 0 17 8.434e-03 7.162e-03 5.959e-04 4.665e-04 1.578144e-01 2.455199e-04 2.018863e-03 -6.000000e+00 4.916974e-03 230.41 -2.00 3.69 -2.00 314.18 0.00e+00 4.090811e-04 1.769839e-05 1.345807e-05 -6.000000e+00 2.113914e-04 279.52 -2.00 20.00 -2.00 313.71 0.00e+00 1.263 0.000 302.00 328.00 3 1.9076e+00 6.2881e-04 1.4839e-02 -6.0000e+00 1.2309e-02 2.4637e-02 6.9294e-04 8.5930e-03 -6.0000e+00 1.3308e-02 -2.8724e-03 3.9741e-04 4.1811e-03 -6.0000e+00 7.8941e-03 -1.9093e-03 1.7212e-04 1.1822e-03 -6.0000e+00 3.3596e-03 2.0477e-02 2.2260e-04 1.3162e-05 1.6133e-05 -6.0000e+00 2.3189e-04 1.5419e-02 1.1181e-04 12 9 1 12 1 1 99.99 25.41 0.33 0.01542 0.01709 214 139 2 8 0 40.530 19.99 25.41 28.41 35.25 33.75 0.6 997.61 122 176 -51 -1984 -2419 -1463 -449 530 904 -277 -1437 -1229 -558 -68 818 328 181 556 764 1107 1048 668 1194 692 464 703 333 -293 -414 515 946 1026 1466 -114 -2373 -2065 -2143 -1595 -400 -239 -776 -757 -670 260 -593 -250 -566 -609 -822 -574 431 532 809 1197 794 817 871 479 451 322 734 1000 1493 1713 861 -240 -448 -944 -139 718 613 659 387 636 398 -94 -662 -1266 -1122 -928 -1119 -1180 -1871 -2662 -1128 -643 -348 253 580 546 303 231 -345 -375 -26 58 480 929 667 318 112 -676 -1343 -570 -513 -728 -606 -430 -383 280 577 726 481 395 -131 -229 -192 -38 181 411 160 305 449 421 559 605 121 433 433 254 226 -18 -158 -294 44 13 -163 319 78 -114 -231 -502 -936 52 80 -23 -861 -978 -589 -176 225 397 -129 -661 -560 -273 -35 437 181 103 319 448 664 638 402 724 419 291 453 216 -179 -242 301 537 606 911 -71 -1471 -1226 -1310 -1057 -296 -191 -656 -641 -581 226 -514 -214 -493 -509 -688 -469 359 451 688 1061 728 729 788 435 417 296 663 955 1472 1725 874 -233 -412 -858 -128 703 623 683 407 672 398 -92 -600 -1104 -973 -847 -1100 -1193 -1980 -2958 -1274 -756 -419 306 712 672 357 256 -371 -387 -27 63 535 1106 831 395 132 -777 -1497 -651 -599 -885 -746 -552 -497 368 792 987 651 513 -165 -273 -229 -46 222 530 211 403 585 545 701 740 145 502 520 313 283 -23 -202 -383 58 18 -231 450 112 -163 -330 -699 -1274 SS 20260218T234420.5Z 9545.989126 561 1 4.34 2 36.94 29.73 52.05 46.49 0.00 1 0.00 1 0 17 8.319e-03 7.179e-03 6.836e-04 5.462e-04 1.561950e-01 2.877969e-04 1.996353e-03 -6.000000e+00 4.850043e-03 230.41 -2.00 3.69 -2.00 314.04 0.00e+00 4.159469e-04 2.035372e-05 1.332227e-05 -6.000000e+00 2.085133e-04 279.52 -2.00 20.00 -2.00 313.59 0.00e+00 1.250 0.000 302.00 328.00 3 1.5551e+00 7.3612e-04 1.4681e-02 -6.0000e+00 1.2141e-02 2.5984e-02 8.1058e-04 8.4989e-03 -6.0000e+00 1.3127e-02 -3.0296e-03 4.6551e-04 4.1332e-03 -6.0000e+00 7.7866e-03 -1.7338e-03 2.0118e-04 1.1670e-03 -6.0000e+00 3.3139e-03 2.9580e-02 2.0719e-04 1.5392e-05 1.6075e-05 -6.0000e+00 2.2874e-04 1.5416e-02 1.1288e-04 12 9 1 12 1 1 99.67 25.41 0.37 0.01542 0.01697 75 99 2 8 0 57.060 20.00 25.41 28.89 35.25 33.75 0.6 999.43 391 -145 -33 -1732 -2126 -1349 -301 397 1037 -314 -1420 -953 -488 -155 831 463 -49 403 710 1032 1099 621 1252 732 475 816 218 -399 -470 394 825 1050 1479 -93 -2327 -2192 -2318 -1481 -557 -326 -794 -738 -652 310 -511 -323 -510 -594 -851 -509 494 596 880 1256 861 809 833 529 264 385 787 882 1532 1701 784 -177 -422 -872 -165 520 503 762 405 659 401 -84 -571 -1277 -1075 -927 -1151 -1195 -1820 -2622 -1097 -670 -286 284 625 541 297 210 -404 -401 -42 103 401 954 651 296 142 -756 -1393 -597 -403 -727 -610 -537 -387 282 604 632 498 396 -107 -177 -146 -35 243 451 168 316 504 418 499 644 117 418 447 272 172 -20 -256 -330 13 21 -58 327 90 -80 -271 -511 -952 178 -68 -16 -810 -916 -545 -125 172 491 -151 -673 -446 -246 -82 467 271 -28 236 426 633 683 382 774 457 307 522 140 -251 -280 232 496 631 936 -59 -1466 -1325 -1458 -1015 -418 -261 -677 -634 -574 273 -449 -282 -434 -500 -711 -414 410 508 758 1127 777 737 769 490 241 348 725 838 1511 1727 803 -173 -396 -801 -153 506 515 800 433 685 404 -81 -523 -1116 -933 -854 -1121 -1215 -1948 -2878 -1233 -772 -339 349 761 658 344 231 -426 -413 -44 109 455 1137 798 363 169 -870 -1581 -673 -470 -889 -761 -685 -502 372 815 868 664 513 -133 -211 -173 -42 300 575 221 417 654 537 616 787 139 492 532 334 217 -25 -330 -425 18 29 -80 455 128 -112 -379 -698 -1297 SS 20260218T235016.6Z 9545.993247 570 1 0.73 2 36.44 27.44 51.34 44.88 0.00 1 0.00 1 0 17 8.493e-03 7.166e-03 1.022e-03 8.189e-04 1.548115e-01 4.309557e-04 1.990622e-03 -6.000000e+00 4.950439e-03 230.41 -2.00 3.69 -2.00 314.04 0.00e+00 4.401631e-04 3.043412e-05 1.145190e-05 -6.000000e+00 2.129033e-04 279.52 -2.00 20.00 -2.00 313.58 0.00e+00 1.242 0.000 302.00 328.00 3 5.6938e-01 1.1020e-03 1.4589e-02 -6.0000e+00 1.2392e-02 1.9891e-02 1.2139e-03 8.4576e-03 -6.0000e+00 1.3399e-02 -2.1323e-03 6.9712e-04 4.1133e-03 -6.0000e+00 7.9484e-03 -2.1357e-03 3.0086e-04 1.1660e-03 -6.0000e+00 3.3818e-03 8.0242e-02 -1.4613e-04 2.3079e-05 1.6215e-05 -6.0000e+00 2.3356e-04 1.5682e-02 4.3229e-05 12 9 1 12 1 1 73.68 25.41 0.37 0.01568 0.01458 33 265 2 8 0 21.230 19.99 25.41 29.17 35.25 33.75 0.6 1001.35 374 69 -141 -2029 -2270 -1141 -633 1228 669 -243 -1760 -914 -527 -250 746 686 46 465 634 966 1126 770 983 592 609 827 505 -555 -665 559 1012 1393 1671 63 -2500 -2134 -2335 -1556 -440 -228 -770 -832 -669 319 -468 -337 -562 -630 -792 -570 482 653 921 1208 752 663 870 537 361 309 641 945 1453 1542 744 -78 -369 -889 -116 592 546 575 436 508 288 -18 -403 -1180 -844 -895 -1001 -1233 -1851 -2642 -1105 -711 -191 171 615 502 387 231 -111 -403 95 164 576 861 644 327 -44 -702 -1504 -719 -479 -788 -581 -532 -384 244 451 620 438 373 -134 -18 -47 -35 233 441 55 342 431 456 562 520 181 662 540 388 141 -3 -169 -241 -71 58 -82 273 -81 -114 -222 -471 -955 171 33 -67 -953 -979 -482 -265 553 318 -117 -840 -429 -267 -134 407 404 27 275 384 598 682 478 594 374 384 535 328 -354 -401 331 612 842 1065 40 -1592 -1300 -1484 -1046 -324 -185 -650 -709 -584 278 -408 -292 -487 -540 -654 -472 396 550 807 1075 675 601 797 494 327 285 588 892 1428 1564 760 -76 -343 -810 -107 572 556 604 464 527 289 -17 -366 -1050 -744 -817 -967 -1251 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