File name: Pandora272s1_Lauder_20251124_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T063304.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 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_v6d20241202.txt Level 1 file used: Pandora272s1_Lauder_20251124_L1_smca1c6d20241202p1-8.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: 20251124 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: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0455 305.1861 305.3267 305.4672 305.6077 305.7483 305.8888 306.0293 306.1697 306.3102 306.4507 306.5911 306.7315 306.8720 307.0124 307.1528 307.2931 307.4335 307.5739 307.7142 307.8545 307.9949 308.1352 308.2755 308.4158 308.5560 308.6963 308.8365 308.9768 309.1170 309.2572 309.3974 309.5376 309.6778 309.8179 309.9581 310.0982 310.2383 310.3784 310.5185 310.6586 310.7987 310.9388 311.0788 311.2189 311.3589 311.4989 311.6389 311.7789 311.9189 312.0589 312.1988 312.3388 312.4787 312.6186 312.7585 312.8984 313.0383 313.1782 313.3180 313.4579 313.5977 313.7375 313.8773 314.0171 314.1569 314.2967 314.4364 314.5762 314.7159 314.8556 314.9954 315.1351 315.2747 315.4144 315.5541 315.6937 315.8334 315.9730 316.1126 316.2522 316.3918 316.5314 316.6710 316.8105 316.9501 317.0896 317.2291 317.3686 317.5081 317.6476 317.7871 317.9265 318.0660 318.2054 318.3448 318.4842 318.6236 318.7630 318.9024 319.0417 319.1811 319.3204 319.4598 319.5991 319.7384 319.8777 320.0169 320.1562 320.2955 320.4347 320.5739 320.7131 320.8523 320.9915 321.1307 321.2699 321.4090 321.5482 321.6873 321.8264 321.9655 322.1046 322.2437 322.3828 322.5219 322.6609 322.7999 322.9390 323.0780 323.2170 323.3560 323.4949 323.6339 323.7729 323.9118 324.0507 324.1896 324.3285 324.4674 324.6063 324.7452 324.8840 --------------------------------------------------------------------------------------- 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 20251123T195235.5Z 9458.828189 707 1 2.67 2 60.85 90.53 85.04 123.67 0.00 1 0.00 1 0 17 1.169e-02 6.999e-03 3.626e-03 1.713e-03 3.014117e-01 8.865946e-04 3.780784e-03 -6.000000e+00 6.823675e-03 230.70 -2.00 3.69 -2.00 316.31 0.00e+00 5.599533e-04 9.662644e-05 7.614467e-05 -6.000000e+00 2.895389e-04 276.55 -2.00 20.00 -2.00 315.72 0.00e+00 2.043 0.000 302.00 328.00 3 2.5469e+00 2.3145e-03 2.5563e-02 -6.0000e+00 1.7111e-02 2.9102e-02 2.5745e-03 1.6307e-02 -6.0000e+00 1.8506e-02 -9.1301e-03 1.4944e-03 7.9683e-03 -6.0000e+00 1.0956e-02 2.6974e-04 7.0008e-04 2.2486e-03 -6.0000e+00 4.6450e-03 3.9945e-03 2.1111e-04 4.8445e-05 2.6393e-05 -6.0000e+00 3.2148e-04 1.6573e-03 0.0000e+00 12 9 1 12 1 1 39.79 25.29 0.32 0.00166 0.00324 13 30 4 8 0 190.220 19.99 25.29 15.69 35.00 33.75 1.1 947.34 -2773 -261 -901 -2295 -1290 -5130 -3712 -2801 -982 -2815 -2275 -2531 -2665 -1888 164 1282 219 1559 471 904 2001 1196 1493 1455 734 811 264 -368 -100 872 -126 983 1521 256 -2938 -1386 -2160 -2065 19 5 -249 68 -703 617 92 -569 -174 -118 -914 -337 326 764 937 1056 503 523 1189 513 38 242 831 843 1588 2006 781 342 -127 -811 -268 510 503 327 593 315 147 -234 -628 -978 -1576 -1072 -1554 -1215 -1822 -2409 -1151 -593 -216 454 598 733 219 72 -124 -468 -91 41 420 1179 685 118 28 -897 -1631 -670 -641 -880 -400 -563 -27 217 548 715 327 269 -213 -289 -40 116 435 402 185 326 468 354 573 623 121 407 621 144 64 80 -164 -157 -64 -110 -14 412 166 -241 -196 -548 -945 -469 -48 -172 -423 -227 -898 -677 -518 -199 -620 -499 -572 -632 -513 47 407 70 512 164 325 726 435 554 539 288 331 110 -146 -37 333 -49 408 647 116 -1300 -583 -994 -1034 10 3 -159 45 -470 414 62 -386 -116 -77 -619 -228 221 533 692 795 397 405 934 407 29 193 650 703 1381 1811 703 300 -108 -674 -230 471 482 322 587 313 142 -211 -532 -810 -1342 -944 -1504 -1224 -1939 -2626 -1282 -687 -256 554 740 883 253 81 -132 -490 -95 46 492 1450 894 156 36 -1109 -1932 -780 -783 -1120 -515 -745 -37 303 797 1049 483 385 -290 -384 -52 153 595 575 269 469 660 495 774 821 157 528 825 197 91 115 -243 -233 -97 -174 -22 672 270 -396 -310 -857 -1468 SS 20251123T195426.4Z 9458.829472 709 1 54.35 2 60.52 90.21 84.78 123.37 0.00 1 0.00 1 0 17 1.246e-02 7.015e-03 1.092e-03 4.801e-04 2.984557e-01 2.477337e-04 3.752654e-03 -6.000000e+00 7.270824e-03 230.70 -2.00 3.69 -2.00 316.47 0.00e+00 6.073765e-04 2.822147e-05 8.542042e-05 -6.000000e+00 3.085462e-04 276.55 -2.00 20.00 -2.00 315.89 0.00e+00 2.023 0.000 302.00 328.00 3 3.0799e+00 6.4810e-04 2.5342e-02 -6.0000e+00 1.8232e-02 3.0528e-02 7.2095e-04 1.6200e-02 -6.0000e+00 1.9720e-02 -9.6839e-03 4.2122e-04 7.9136e-03 -6.0000e+00 1.1675e-02 1.1886e-03 1.9974e-04 2.2384e-03 -6.0000e+00 4.9487e-03 2.3976e-03 6.4600e-05 1.3590e-05 2.6560e-05 -6.0000e+00 3.4261e-04 2.6976e-03 0.0000e+00 11 8 0 10 0 0 99.79 25.29 0.31 0.00270 0.00318 291 30 4 8 0 186.740 19.99 25.29 15.88 35.00 33.75 1.1 948.27 -3448 -1293 -1770 -2980 -1485 -4388 -3265 -3333 -1864 -2818 -3604 -3312 -2397 -1623 306 518 -383 1330 715 1778 1487 1216 1284 1304 789 1342 453 92 -631 19 665 1159 1454 615 -2880 -2069 -3003 -2056 -630 -24 -628 -140 -239 842 85 455 10 -96 -857 -243 798 725 965 1176 773 815 883 383 254 406 920 1054 1622 1885 889 -22 -119 -996 -156 527 409 573 269 466 100 -367 -771 -1466 -1275 -1133 -1219 -1098 -1917 -2496 -1220 -651 -323 207 619 533 379 216 -224 -385 -157 -38 419 932 664 253 -92 -884 -1588 -658 -370 -745 -542 -382 -295 390 641 614 377 323 -127 -124 -119 152 253 446 144 299 542 425 492 604 47 374 512 283 322 -27 -247 -211 73 21 -79 327 167 -201 -287 -519 -1006 -529 -215 -307 -497 -237 -689 -536 -556 -341 -556 -716 -674 -545 -391 83 157 -115 411 233 594 509 415 447 481 286 504 174 34 -231 7 253 445 605 271 -1245 -857 -1361 -995 -337 -14 -396 -93 -155 550 55 297 7 -64 -570 -161 524 513 687 886 582 626 691 302 196 310 714 871 1388 1663 807 -20 -100 -853 -131 473 393 558 265 462 93 -323 -642 -1207 -1069 -1013 -1183 -1093 -2008 -2757 -1366 -752 -392 251 760 638 437 237 -235 -399 -167 -43 488 1168 874 336 -116 -1081 -1871 -789 -461 -962 -705 -507 -411 556 943 907 565 470 -177 -166 -155 203 346 635 207 439 778 609 666 802 61 479 667 385 451 -39 -361 -317 112 34 -129 530 276 -327 -462 -810 -1568 SS 20251123T195638.1Z 9458.830997 711 1 54.45 2 60.13 89.82 84.47 123.02 0.00 1 0.00 1 0 17 1.619e-02 7.424e-03 2.308e-03 9.293e-04 2.955176e-01 4.791302e-04 3.701288e-03 -6.000000e+00 9.443781e-03 230.70 -2.00 3.69 -2.00 316.64 0.00e+00 6.663244e-04 5.704376e-05 9.699223e-05 -6.000000e+00 4.007585e-04 276.55 -2.00 20.00 -2.00 316.05 0.00e+00 1.999 0.000 302.00 328.00 3 4.3662e+00 1.2569e-03 2.5059e-02 -6.0000e+00 2.3681e-02 4.1485e-02 1.3991e-03 1.6033e-02 -6.0000e+00 2.5613e-02 -1.1001e-02 8.2220e-04 7.8339e-03 -6.0000e+00 1.5164e-02 2.3051e-03 3.9424e-04 2.2263e-03 -6.0000e+00 6.4277e-03 6.7644e-04 1.9406e-04 2.6440e-05 2.5680e-05 -6.0000e+00 4.4500e-04 2.7061e-03 0.0000e+00 11 8 0 10 0 0 99.98 25.28 0.18 0.00271 0.00416 69 7 1 8 0 789.050 20.01 25.28 16.07 35.00 33.75 1.1 949.24 -4650 1473 -1195 -240 -6785 -5052 -4292 -6843 -1091 -5386 -5006 -3554 -1647 -1647 -222 971 -651 1985 -288 2360 694 1116 -245 1379 1421 1675 241 596 -129 365 -423 1786 1140 2217 -4187 -1400 -2763 -2204 -659 1 -1004 496 -455 681 69 1023 187 23 -1246 94 1047 561 871 767 845 623 974 -89 21 1011 1259 1458 1596 1715 515 -248 246 -1254 40 445 446 678 176 621 -13 -209 -776 -1800 -1428 -1116 -1200 -972 -1948 -2582 -1320 -546 -352 208 543 207 480 45 19 -533 -409 -47 264 1021 692 585 9 -852 -1893 -575 -153 -696 -515 -294 -291 243 663 675 305 467 -128 -83 -140 53 187 577 136 341 597 412 539 585 -77 344 377 235 411 -26 -153 -376 32 -35 -125 433 165 -106 -353 -529 -955 -657 217 -187 -35 -948 -663 -590 -1068 -179 -983 -909 -654 -335 -386 -54 261 -188 584 -91 750 229 364 -83 448 483 591 87 204 -45 124 -143 639 446 901 -1716 -539 -1169 -990 -348 1 -610 312 -299 449 45 671 122 15 -797 59 690 376 616 576 624 470 746 -69 16 795 954 1176 1325 1533 474 -216 209 -1049 34 404 427 682 171 612 -12 -185 -656 -1446 -1166 -961 -1110 -999 -2083 -2779 -1494 -631 -429 250 660 257 552 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