File name: Pandora32s1_GreenbeltMD_20240413_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240414T051613.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240413_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20240413 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: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- 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 20240413T130200.2Z 8869.543058 114 1 48.75 2 62.05 101.13 96.91 45.50 0.00 1 0.00 1 0 17 2.734e-02 5.893e-03 1.496e-02 2.572e-03 3.581095e-01 1.299614e-03 4.225888e-03 -6.000000e+00 1.566019e-02 228.68 -2.00 3.47 -2.00 318.29 0.00e+00 5.326605e-04 2.459568e-04 1.876248e-04 -6.000000e+00 6.830004e-04 281.08 -2.00 20.00 -2.00 317.60 0.00e+00 2.123 0.000 302.00 328.00 3 5.1096e+00 3.5045e-03 2.8122e-02 -6.0000e+00 3.9028e-02 2.5955e-02 3.9804e-03 1.8362e-02 -6.0000e+00 4.2309e-02 -8.9258e-05 2.6423e-03 9.0690e-03 -6.0000e+00 2.5166e-02 -5.0298e-03 1.3773e-03 2.5831e-03 -6.0000e+00 1.0699e-02 2.3856e-04 -2.4170e-04 7.2945e-05 2.7423e-05 -6.0000e+00 7.2814e-04 8.2605e-03 -6.6824e-05 10 0 0 10 0 0 99.96 21.53 0.39 0.00826 0.00644 29 7 1 5 0 1680.900 26.11 20.02 21.53 17.54 4.5 971.04 1107 -13057 -794 -9097 -7353 -16107 -2104 -5906 -6625 -4162 -8248 -5110 -6669 -5968 3186 129 -2633 -174 1034 4307 771 -100 1826 -1568 1094 1482 1210 -491 690 -2187 4716 -3426 -847 -748 -3024 314 -4329 -1151 -2146 -670 -461 290 837 -804 192 128 866 618 -1327 -43 77 869 1463 1284 739 941 1460 -198 137 663 484 839 1988 2124 260 -40 190 84 703 1301 -13 40 -640 431 -647 -760 -1048 -1361 -982 -1155 -969 -1182 -1243 -1880 -109 -856 113 -192 255 468 401 754 -3 -55 876 390 216 453 661 -335 -237 -279 -907 17 -1025 -1033 -657 -373 120 694 -14 384 153 280 179 150 161 -67 44 98 -314 -239 523 341 244 378 145 449 192 882 200 -481 -143 9 365 -300 -225 -329 108 72 -48 -87 -416 51 -785 -45 -547 -397 -883 -105 -341 -436 -289 -604 -372 -550 -574 329 15 -351 -24 148 622 119 -16 283 -265 193 274 227 -91 119 -381 817 -708 -189 -177 -708 68 -1033 -305 -681 -245 -186 123 365 -363 86 58 388 274 -597 -19 36 436 776 719 432 562 888 -122 83 395 293 535 1355 1551 198 -29 132 57 493 1002 -11 36 -572 373 -537 -584 -743 -926 -683 -887 -824 -1095 -1226 -1935 -115 -963 132 -230 307 552 452 796 -3 -53 876 422 255 576 890 -457 -312 -344 -1064 19 -1273 -1344 -879 -515 172 1039 -23 618 245 431 262 209 222 -96 64 152 -494 -373 796 506 353 528 196 601 270 1308 312 -773 -233 14 631 -540 -413 -611 202 132 -86 -152 -712 SS 20240413T135935.7Z 8869.583052 157 1 3.82 2 51.32 112.33 88.66 54.44 0.00 1 0.00 1 0 17 1.421e-02 7.125e-03 9.722e-03 4.281e-03 2.734152e-01 2.176698e-03 3.263751e-03 -6.000000e+00 8.141469e-03 228.69 -2.00 3.47 -2.00 316.41 0.00e+00 1.686577e-04 2.499547e-04 8.347796e-05 -6.000000e+00 3.550924e-04 281.08 -2.00 20.00 -2.00 315.74 0.00e+00 1.597 0.000 302.00 328.00 3 4.1425e+00 5.6729e-03 2.1223e-02 -6.0000e+00 2.0290e-02 2.6217e-02 6.3385e-03 1.3866e-02 -6.0000e+00 2.1997e-02 -2.9481e-03 3.6917e-03 6.8211e-03 -6.0000e+00 1.3084e-02 -8.1577e-04 1.7488e-03 1.9055e-03 -6.0000e+00 5.5621e-03 1.1937e-03 -4.2117e-04 1.1945e-04 2.2122e-05 -6.0000e+00 3.7861e-04 7.7070e-03 -1.2124e-04 12 9 1 12 1 1 999.00 21.59 0.30 0.00771 0.00454 2 9 1 5 0 1271.480 26.11 20.00 21.59 18.07 4.4 973.15 -462 744 -4968 -2142 -8054 -4077 3452 -3246 2418 -3323 353 -3392 1648 -1235 1715 649 -168 847 -124 1148 289 1771 1681 807 296 271 404 -931 -1507 1549 1421 3452 1368 -107 -3435 -2765 -299 -18 -390 899 -1586 -749 -1659 -569 232 100 140 -963 30 -797 704 745 233 1502 702 459 519 -556 1156 -37 1644 1359 1469 1348 -396 -552 -531 566 223 1400 -40 191 240 664 650 -12 -565 -759 -1169 -660 -1008 -710 -2337 -1456 -397 -1197 91 -515 641 -202 331 571 -213 626 -60 29 490 864 425 -876 -589 -398 -201 -256 -939 -600 -661 -601 144 -58 585 403 536 328 134 653 180 -74 487 45 -935 385 16 72 1122 220 517 1192 155 -102 156 -67 -462 -307 647 -70 -339 466 -111 -184 158 -564 -775 -72 127 -924 -378 -1363 -621 505 -554 438 -672 69 -690 347 -300 456 190 -52 268 -41 386 100 605 578 290 112 106 160 -359 -554 540 510 1301 560 -46 -1468 -1131 -125 -8 -206 528 -1021 -498 -1132 -389 158 68 95 -647 20 -526 472 525 172 1136 547 364 417 -450 916 -29 1302 1120 1276 1227 -369 -498 -453 467 189 1269 -39 192 243 659 622 -11 -480 -619 -964 -581 -960 -718 -2499 -1592 -447 -1412 111 -641 796 -248 391 640 -226 644 -63 33 580 1081 557 -1163 -757 -486 -235 -302 -1161 -768 -869 -809 198 -83 862 602 791 468 182 853 233 -98 666 65 -1363 556 23 101 1517 291 662 1507 203 -140 221 -96 -674 -456 985 -111 -543 752 -181 -298 251 -877 -1186 SS 20240413T140553.4Z 8869.587424 161 1 48.60 2 50.20 113.71 87.69 55.36 0.00 1 0.00 1 0 17 8.609e-03 5.514e-03 4.267e-04 2.065e-04 2.660400e-01 1.051962e-04 3.189047e-03 -6.000000e+00 4.933853e-03 228.69 -2.00 3.47 -2.00 316.17 0.00e+00 3.395883e-04 1.146404e-05 4.150001e-05 -6.000000e+00 2.151415e-04 281.08 -2.00 20.00 -2.00 315.52 0.00e+00 1.559 0.000 302.00 328.00 3 1.1395e+00 2.7348e-04 2.0702e-02 -6.0000e+00 1.2296e-02 7.5291e-03 3.0508e-04 1.3516e-02 -6.0000e+00 1.3328e-02 -2.4120e-03 1.7648e-04 6.6472e-03 -6.0000e+00 7.9279e-03 -1.4627e-03 8.2417e-05 1.8729e-03 -6.0000e+00 3.3716e-03 2.5482e-02 1.2087e-05 5.7521e-06 2.2080e-05 -6.0000e+00 2.2929e-04 7.1297e-03 -1.4011e-05 10 0 0 10 0 0 99.63 21.60 0.30 0.00713 0.00722 926 217 1 5 0 52.480 26.11 20.00 21.60 18.05 4.4 974.34 -885 -1264 -977 -2920 -3265 -3070 -1591 -540 -72 -652 -2220 -1312 -643 0 385 209 101 545 1079 1027 1277 566 1256 1172 497 461 -51 -533 -291 117 1145 1027 1420 -260 -2236 -1595 -1765 -868 -194 -258 -778 -607 -535 -603 -81 -160 -421 -418 -571 -253 566 836 682 1032 719 868 952 245 480 451 944 1230 1397 1371 315 -192 -158 -184 553 636 15 -42 -77 35 -23 -121 -308 -549 -563 -468 -1053 -1238 -1763 -1718 -903 -812 -338 -76 17 351 216 542 117 593 641 335 388 484 235 -296 -310 -614 -470 184 -512 -902 -657 -549 -131 304 281 202 210 290 134 433 318 291 85 -8 -398 -21 166 221 449 505 253 1027 599 317 203 -31 -97 125 20 -97 -113 59 -86 -273 -166 -390 -550 -159 -257 -207 -610 -611 -527 -275 -103 -15 -140 -484 -283 -150 0 110 67 34 190 390 385 459 204 482 441 200 194 -22 -219 -111 46 457 416 625 -115 -1029 -690 -802 -422 -106 -158 -506 -417 -379 -434 -58 -114 -298 -288 -385 -169 390 617 510 811 560 690 772 200 385 356 754 1041 1227 1240 294 -177 -133 -155 480 595 15 -43 -79 35 -22 -112 -267 -444 -463 -408 -1000 -1255 -1858 -1899 -1010 -939 -413 -93 22 435 250 618 126 606 678 375 464 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