File name: Pandora272s1_Lauder_20250811_L2Fit_fwvt1c2d20241202p1-8.txt File generation date: 20250811T125306.7Z Data description: Level 2 spectral fitting results file Data file version: fwvt1c2p1-8 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_20250811_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: 20250811 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: 1622 1772 Nominal wavelengths inside fitting window [nm]: 492.0513 492.1717 492.2922 492.4126 492.5331 492.6535 492.7739 492.8943 493.0146 493.1350 493.2553 493.3756 493.4959 493.6162 493.7364 493.8567 493.9769 494.0971 494.2173 494.3375 494.4576 494.5777 494.6979 494.8180 494.9381 495.0581 495.1782 495.2982 495.4183 495.5383 495.6583 495.7782 495.8982 496.0181 496.1380 496.2579 496.3778 496.4977 496.6175 496.7374 496.8572 496.9770 497.0968 497.2166 497.3363 497.4560 497.5758 497.6955 497.8151 497.9348 498.0545 498.1741 498.2937 498.4133 498.5329 498.6524 498.7720 498.8915 499.0110 499.1305 499.2500 499.3695 499.4889 499.6083 499.7278 499.8471 499.9665 500.0859 500.2052 500.3245 500.4439 500.5631 500.6824 500.8017 500.9209 501.0401 501.1593 501.2785 501.3977 501.5169 501.6360 501.7551 501.8742 501.9933 502.1124 502.2314 502.3505 502.4695 502.5885 502.7075 502.8264 502.9454 503.0643 503.1832 503.3021 503.4210 503.5399 503.6587 503.7775 503.8963 504.0151 504.1339 504.2527 504.3714 504.4901 504.6089 504.7275 504.8462 504.9649 505.0835 505.2021 505.3207 505.4393 505.5579 505.6764 505.7950 505.9135 506.0320 506.1505 506.2690 506.3874 506.5058 506.6243 506.7426 506.8610 506.9794 507.0977 507.2161 507.3344 507.4527 507.5709 507.6892 507.8074 507.9257 508.0439 508.1621 508.2802 508.3984 508.5165 508.6347 508.7528 508.8708 508.9889 509.1070 509.2250 509.3430 509.4610 509.5790 509.6970 509.8149 509.9328 --------------------------------------------------------------------------------------- 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: Water vapor slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor 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: Water vapor effective temperature [K] Column 28: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for water vapor [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Nitrogen dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen 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: Nitrogen dioxide effective temperature [K] Column 39: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for nitrogen dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 45: 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 46: 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 47: 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 48: 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 49: Ozone effective temperature [K] Column 50: 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 51: 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 52: 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 53: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 54: 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 55: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 56: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 57: Lower limit used for wavelength scaling [nm] Column 58: Upper limit used for wavelength scaling [nm] Column 59: Order of smoothing polynomial Column 60: Smoothing polynomial coefficient, order 0 Column 61: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 62: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 63: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 64: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 65: Smoothing polynomial coefficient, order 1 Column 66: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 67: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 68: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 69: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 70: Mean value of measured data inside fitting window [same units as measurements] Column 71: Wavelength change polynomial coefficient, order 0 Column 72: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 76: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 77: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 78: 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 79: 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 80: 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 81: 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 82: 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 83: 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 84: Atmospheric variability [%], 999=no atmospheric variability was determined Column 85: Wavelength effective temperature [°C], 999=no effective temperature given Column 86: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 87: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 88: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 89: Number of bright count cycles Column 90: Number of dark count cycles Column 91: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 92: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 93: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 94: Integration time [ms] 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: Temperature at electronics board 1 [°C], 999=no temperature signal Column 99: Temperature at electronics board 2 [°C], 999=no temperature signal Column 100: Humidity in head sensor [%], -9=no humidity signal Column 101: Pressure in head sensor [hPa], -9=no pressure signal Columns 102-252: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 253-403: 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 --------------------------------------------------------------------------------------- SQ 20250810T230120.9Z 9353.959270 709 1 55.37 2 64.86 28.18 112.75 230.51 0.00 1 0.00 1 0 22 4.219e-03 4.197e-03 8.304e-04 8.292e-04 1.177396e+03 4.570284e+01 9.256469e+01 -6.000000e+00 2.247695e+02 273.25 -2.00 20.00 -2.00 505.26 0.00e+00 3.230819e-04 2.219658e-05 1.885999e-05 -6.000000e+00 1.152443e-04 273.25 -2.00 20.00 -2.00 500.46 0.00e+00 1.724435e-01 1.623405e-02 9.261940e-03 -6.000000e+00 8.327490e-02 223.11 -2.00 3.69 -2.00 502.06 0.00e+00 2.339 0.000 489.00 513.00 1 7.4653e+00 1.2405e-03 3.3183e-03 -6.0000e+00 6.3650e-03 7.4208e-03 3.2174e-04 2.8390e-04 -6.0000e+00 1.6542e-03 8.0248e-04 1.2451e-03 8.1613e-05 1.4720e-05 -6.0000e+00 4.2481e-04 5.3892e-03 1.6658e-05 11 8 0 10 0 0 44.53 25.26 1.97 0.00539 0.01403 16 2 1 2 0 3460.170 20.00 25.26 17.30 35.00 34.00 0.9 951.58 -856 -663 547 -390 43 206 536 65 677 693 271 82 -149 -339 -588 -151 -18 193 334 -237 97 388 450 273 61 224 402 81 -603 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-545 7 -127 -273 117 409 225 665 837 865 281 130 637 -118 84 310 367 -72 276 187 147 410 251 -117 -151 -283 -728 -538 146 -496 -170 47 -159 516 362 378 562 468 53 -485 -402 -430 -380 SQ 20250810T230251.7Z 9353.960321 711 1 54.62 2 64.73 27.80 112.95 230.19 0.00 1 0.00 1 0 15 4.347e-03 4.323e-03 8.349e-04 8.336e-04 1.146371e+03 4.600677e+01 9.006006e+01 -6.000000e+00 2.315870e+02 273.25 -2.00 20.00 -2.00 505.27 0.00e+00 3.166836e-04 2.230480e-05 1.858349e-05 -6.000000e+00 1.187383e-04 273.25 -2.00 20.00 -2.00 500.47 0.00e+00 1.969709e-01 1.632298e-02 9.061838e-03 -6.000000e+00 8.578343e-02 223.11 -2.00 3.69 -2.00 502.06 0.00e+00 2.328 0.000 489.00 513.00 1 7.4631e+00 1.2474e-03 3.2990e-03 -6.0000e+00 6.5570e-03 6.9526e-03 3.2313e-04 2.7927e-04 -6.0000e+00 1.7036e-03 8.0412e-04 1.1857e-03 8.1994e-05 1.4485e-05 -6.0000e+00 4.3776e-04 2.8169e-03 4.7272e-05 11 8 0 10 0 0 98.19 25.26 1.95 0.00282 0.01104 16 2 1 2 0 3413.050 19.99 25.26 17.26 35.00 34.00 0.9 951.63 -754 -627 483 -262 22 190 669 89 554 603 91 92 -106 -323 -665 -258 -88 314 408 -357 81 282 408 329 125 358 351 -33 -448 -350 -344 -881 -151 275 341 -132 163 -112 -326 762 -43 -56 56 417 22 418 715 878 395 -350 -525 -907 -1002 -759 -319 -618 -345 -233 17 257 189 760 387 249 346 224 99 -264 145 -369 -671 -63 -177 226 -91 431 12 -687 -307 -459 -477 -513 -69 241 -191 -366 -185 -273 -507 -60 -80 227 769 355 360 213 842 -493 -451 -34 -899 -926 -207 -193 -3 -167 -463 76 -718 14 -127 -349 101 540 220 540 670 643 310 254 947 -78 205 144 564 107 370 73 325 440 -18 -95 10 -407 -768 -546 243 -449 -368 102 -435 683 315 418 589 441 70 -374 -430 -447 -596 -731 -615 484 -267 22 197 702 95 585 629 94 94 -109 -329 -677 -263 -88 322 427 -372 84 294 425 344 131 376 366 -34 -464 -351 -349 -879 -152 284 354 -140 170 -116 -333 784 -45 -57 58 431 23 436 741 897 399 -356 -518 -899 -982 -746 -311 -622 -346 -236 17 260 191 766 393 254 349 224 100 -264 142 -359 -648 -61 -172 221 -90 425 12 -665 -292 -446 -453 -493 -66 233 -187 -365 -185 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13 1 1 2 0 3754.130 19.99 25.26 17.25 35.00 34.00 0.9 951.58 -647 -1122 464 -194 -84 243 526 26 416 485 230 80 -217 -534 -699 -249 -225 285 326 -72 57 252 574 318 64 302 523 -58 -835 -72 -543 -940 -67 285 306 -286 140 -173 -21 777 149 315 153 360 93 591 613 694 344 -180 -576 -879 -853 -891 -386 -354 -162 -224 -115 240 102 590 521 215 386 237 122 -304 53 -346 -540 -44 -203 347 88 307 169 -599 -191 -245 -490 -507 -255 427 -96 -387 -332 -225 -500 -141 70 259 816 206 400 242 937 -574 -293 127 -862 -948 -333 -73 72 -206 -361 147 -649 -91 -159 -209 156 220 324 578 590 697 337 188 735 -226 98 273 640 -78 331 55 368 257 248 -311 -66 -416 -748 -566 78 -522 -464 89 -297 447 245 430 571 515 -32 -433 -353 -251 -627 -634 -1089 458 -195 -86 254 544 27 434 512 240 83 -220 -536 -701 -250 -229 295 336 -76 60 265 602 336 68 320 551 -61 -856 -73 -543 -948 -68 289 321 -297 148 -181 -22 787 151 322 158 376 95 622 641 717 351 -180 -575 -858 -822 -864 -381 -350 -164 -230 -118 245 104 602 534 221 393 239 121 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