File name: Pandora252s1_BoulderCO-NCAR_20250907_L2Fit_fout2c3d20230118p1-8.txt File generation date: 20250908T070458.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Ivan Ortega Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 252 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora252_OF_v3d20221123.txt Instrument calibration file used: Pandora252s1_CF_v3d20230118.txt Level 1 file used: Pandora252s1_BoulderCO-NCAR_20250907_L1_smca1c3d20230118p1-8.txt Full location name: National Center for Atmospheric Research Short location name: BoulderCO-NCAR Country of location: United States Location latitude [deg]: 40.0375 Location longitude [deg]: -105.2420 Location altitude [m]: 1616 Local noon date: 20250907 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: Updated OoB with correct parameters based on session 2 First and last pixel inside fitting window: 192 334 Nominal wavelengths inside fitting window [nm]: 305.0965 305.2374 305.3783 305.5193 305.6602 305.8010 305.9419 306.0828 306.2237 306.3645 306.5053 306.6462 306.7870 306.9278 307.0686 307.2094 307.3501 307.4909 307.6316 307.7724 307.9131 308.0538 308.1945 308.3352 308.4759 308.6166 308.7572 308.8979 309.0385 309.1792 309.3198 309.4604 309.6010 309.7416 309.8821 310.0227 310.1633 310.3038 310.4443 310.5848 310.7253 310.8658 311.0063 311.1468 311.2873 311.4277 311.5682 311.7086 311.8490 311.9894 312.1298 312.2702 312.4106 312.5509 312.6913 312.8316 312.9719 313.1123 313.2526 313.3929 313.5332 313.6734 313.8137 313.9539 314.0942 314.2344 314.3746 314.5148 314.6550 314.7952 314.9354 315.0755 315.2157 315.3558 315.4960 315.6361 315.7762 315.9163 316.0564 316.1964 316.3365 316.4765 316.6166 316.7566 316.8966 317.0366 317.1766 317.3166 317.4566 317.5965 317.7365 317.8764 318.0164 318.1563 318.2962 318.4361 318.5759 318.7158 318.8557 318.9955 319.1353 319.2752 319.4150 319.5548 319.6946 319.8344 319.9741 320.1139 320.2536 320.3934 320.5331 320.6728 320.8125 320.9522 321.0918 321.2315 321.3712 321.5108 321.6504 321.7901 321.9297 322.0693 322.2088 322.3484 322.4880 322.6275 322.7671 322.9066 323.0461 323.1856 323.3251 323.4646 323.6041 323.7435 323.8830 324.0224 324.1618 324.3012 324.4406 324.5800 324.7194 324.8588 324.9981 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal 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: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20250907T155439.5Z 9381.662957 325 1 54.59 2 53.59 117.12 128.50 297.33 0.00 1 0.00 1 0 17 8.011e-03 6.279e-03 3.010e-04 1.992e-04 2.215544e-01 1.041948e-04 2.621647e-03 -6.000000e+00 4.704992e-03 228.86 -2.00 3.45 -2.00 315.22 0.00e+00 3.199420e-04 9.281144e-06 2.461843e-05 -6.000000e+00 2.056923e-04 280.48 -2.00 20.00 -2.00 314.62 0.00e+00 1.680 0.000 302.00 328.00 3 1.7375e+00 2.6802e-04 1.7888e-02 -6.0000e+00 1.1719e-02 3.5724e-04 2.9860e-04 1.1110e-02 -6.0000e+00 1.2733e-02 -8.7866e-03 1.7033e-04 5.4399e-03 -6.0000e+00 7.5720e-03 1.7998e-04 7.3744e-05 1.5173e-03 -6.0000e+00 3.1477e-03 1.8013e-02 1.1417e-04 5.9858e-06 2.1118e-05 -6.0000e+00 2.3448e-04 -1.0464e-02 3.0919e-05 10 0 0 10 0 0 99.87 26.86 0.35 -0.01046 -0.00961 979 97 1 5 0 55.750 35.50 20.00 26.86 27.64 10.6 1007.42 -226 -692 -1444 -2907 -1967 -1134 -356 491 107 -1396 -1397 -290 -342 145 484 107 440 935 1004 1153 880 1296 1426 958 841 341 -547 -447 375 893 1053 1271 408 -1784 -1867 -1199 -1338 -366 -341 -866 -861 -624 -629 -712 -202 -559 -665 -472 -424 445 783 790 1049 850 659 956 579 288 632 987 1344 1428 1292 522 -361 -88 4 267 1136 277 -97 -2 -115 -43 -293 -153 -221 -130 -80 -857 -1244 -1716 -1998 -1166 -954 -743 -266 -70 -159 -8 381 305 643 1088 633 506 659 210 -448 -400 -492 -380 495 153 -1008 -850 -536 -471 254 280 108 -50 39 103 398 778 637 490 157 -412 -343 93 85 293 667 417 1003 1191 303 103 -117 -267 66 234 -141 -256 115 -43 -322 -211 -243 -447 -309 -70 -229 -481 -910 -587 -325 -107 153 37 -472 -469 -100 -130 59 207 47 200 436 483 542 420 645 689 488 429 179 -284 -227 187 437 514 663 217 -971 -1011 -645 -756 -220 -224 -629 -651 -473 -488 -554 -156 -429 -516 -355 -312 328 603 625 843 713 550 810 497 246 531 828 1168 1288 1215 500 -340 -81 4 233 1026 265 -97 -2 -119 -43 -285 -138 -194 -110 -71 -808 -1233 -1810 -2181 -1296 -1102 -868 -325 -85 -192 -10 436 335 670 1111 669 573 781 259 -563 -501 -592 -446 561 182 -1239 -1074 -690 -617 340 387 151 -72 55 136 506 962 794 628 210 -560 -476 126 114 387 853 522 1231 1483 384 136 -156 -367 92 333 -203 -377 173 -66 -497 -317 -361 -659 -452 SS 20250907T160121.5Z 9381.667610 329 1 54.62 2 52.46 118.65 129.56 298.86 0.00 1 0.00 1 0 17 8.004e-03 6.283e-03 2.028e-04 1.373e-04 2.159550e-01 7.196306e-05 2.564416e-03 -6.000000e+00 4.698989e-03 228.86 -2.00 3.45 -2.00 315.10 0.00e+00 2.943000e-04 6.231670e-06 2.292089e-05 -6.000000e+00 2.055023e-04 280.48 -2.00 20.00 -2.00 314.51 0.00e+00 1.637 0.000 302.00 328.00 3 1.0484e+00 1.8499e-04 1.7440e-02 -6.0000e+00 1.1703e-02 -2.9825e-03 2.0589e-04 1.0844e-02 -6.0000e+00 1.2718e-02 -7.9645e-03 1.1748e-04 5.3132e-03 -6.0000e+00 7.5633e-03 -1.6149e-05 5.0696e-05 1.4780e-03 -6.0000e+00 3.1424e-03 3.7598e-02 -2.0996e-04 4.1363e-06 2.0820e-05 -6.0000e+00 2.3434e-04 -8.8392e-03 -3.7912e-05 10 0 0 10 0 0 6.44 26.86 0.34 -0.00884 -0.01042 1769 175 1 5 0 30.870 35.50 20.00 26.86 28.64 10.8 1018.72 -164 -684 -1450 -2939 -2087 -904 -157 480 20 -1351 -1416 -239 -88 226 590 84 382 872 1028 1136 844 1273 1455 934 867 313 -562 -423 402 969 1155 1216 359 -1825 -1907 -1128 -1376 -313 -278 -874 -937 -632 -690 -729 -256 -545 -676 -570 -426 432 775 770 1040 818 612 979 560 261 629 953 1288 1432 1209 475 -357 -140 -25 305 1189 236 -98 -17 -153 -88 -263 -234 -210 -73 -80 -850 -1250 -1696 -1981 -1102 -924 -730 -248 -63 -133 17 422 319 664 1109 643 506 640 195 -476 -436 -465 -362 483 127 -999 -879 -528 -465 234 268 90 -39 35 111 412 812 639 492 119 -448 -368 79 82 358 668 424 1031 1156 265 57 -140 -269 59 226 -138 -251 114 -43 -322 -189 -214 -434 -314 -53 -226 -482 -969 -654 -271 -50 158 7 -482 -501 -87 -33 92 266 39 183 409 497 564 424 636 741 480 466 173 -307 -216 200 473 590 635 200 -995 -1031 -605 -780 -190 -185 -645 -722 -489 -546 -579 -202 -426 -516 -436 -318 322 605 618 849 676 520 844 489 227 537 814 1139 1317 1129 465 -343 -128 -22 269 1089 229 -98 -17 -157 -89 -252 -214 -186 -62 -70 -788 -1257 -1770 -2143 -1215 -1061 -851 -302 -77 -161 20 480 347 701 1148 690 567 753 239 -597 -544 -555 -422 557 150 -1223 -1109 -679 -610 313 371 127 -55 48 146 519 996 790 625 159 -609 -509 107 111 471 850 526 1253 1427 342 75 -187 -366 80 321 -199 -370 173 -65 -487 -285 -318 -626 -458 SS 20250907T160648.0Z 9381.671389 332 1 54.62 2 51.55 119.92 130.41 300.13 0.00 1 0.00 1 0 17 7.829e-03 6.220e-03 1.948e-04 1.339e-04 2.116168e-01 7.004840e-05 2.512692e-03 -6.000000e+00 4.595874e-03 228.86 -2.00 3.45 -2.00 315.04 0.00e+00 3.169475e-04 6.007259e-06 2.241536e-05 -6.000000e+00 2.009905e-04 280.48 -2.00 20.00 -2.00 314.45 0.00e+00 1.605 0.000 302.00 328.00 3 1.0355e+00 1.7987e-04 1.7090e-02 -6.0000e+00 1.1446e-02 -3.5297e-03 2.0015e-04 1.0624e-02 -6.0000e+00 1.2439e-02 -7.3199e-03 1.1422e-04 5.2061e-03 -6.0000e+00 7.3973e-03 -2.9092e-04 4.9220e-05 1.4527e-03 -6.0000e+00 3.0734e-03 3.9424e-02 -1.3830e-04 4.0218e-06 2.0540e-05 -6.0000e+00 2.2919e-04 -8.3508e-03 -1.6933e-05 10 0 0 10 0 0 82.79 26.86 0.34 -0.00835 -0.00939 1765 175 1 5 0 30.940 35.50 19.99 26.86 30.28 10.7 1028.39 -107 -722 -1388 -2809 -1765 -931 -42 764 81 -1293 -1300 -76 -193 289 521 67 394 916 976 1158 808 1167 1408 824 871 260 -505 -430 355 953 1098 1268 423 -1887 -1815 -1156 -1269 -270 -347 -914 -903 -679 -715 -717 -239 -584 -651 -535 -417 440 747 726 1001 832 595 963 523 266 709 974 1299 1457 1252 488 -391 -161 -16 345 1123 250 -110 -36 -143 -73 -235 -213 -212 -82 -36 -867 -1207 -1683 -1950 -1114 -943 -737 -264 -80 -145 20 411 336 590 1089 629 507 609 185 -468 -402 -460 -364 491 153 -1013 -854 -533 -486 235 270 104 -33 38 89 434 778 614 492 123 -458 -342 69 89 332 643 415 1021 1128 323 85 -145 -248 60 207 -149 -255 142 -47 -308 -193 -213 -452 -314 -35 -251 -484 -970 -544 -293 -13 263 29 -482 -480 -29 -76 122 233 31 187 446 490 570 403 578 711 439 465 143 -273 -227 183 481 553 682 232 -1059 -1008 -638 -739 -168 -238 -670 -691 -523 -562 -566 -187 -454 -509 -405 -318 336 577 577 835 702 515 822 452 229 616 848 1138 1327 1192 472 -372 -149 -15 301 1015 240 -112 -37 -145 -73 -229 -197 -185 -71 -31 -814 -1197 -1733 -2081 -1213 -1071 -871 -318 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