File name: Pandora32s1_GreenbeltMD_20250205_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250206T052509.4Z 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 v1.8.70 Instrument operation file used: Pandora32_OF_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250205_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: 20250205 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 20250205T175101.0Z 9167.743762 266 1 48.59 2 55.11 188.70 70.97 76.80 0.00 1 0.00 1 0 17 8.232e-03 5.606e-03 4.588e-04 2.506e-04 2.261636e-01 1.256494e-04 2.737468e-03 -6.000000e+00 4.650373e-03 224.63 -2.00 3.47 -2.00 315.82 0.00e+00 3.849135e-04 1.266148e-05 2.988437e-05 -6.000000e+00 2.017376e-04 276.38 -2.00 20.00 -2.00 315.27 0.00e+00 1.743 0.000 302.00 328.00 3 1.4594e+00 3.2284e-04 2.0568e-02 -6.0000e+00 1.1500e-02 3.1298e-03 3.6074e-04 1.1320e-02 -6.0000e+00 1.2507e-02 -4.2529e-03 2.0823e-04 5.6173e-03 -6.0000e+00 7.4427e-03 -1.4008e-03 9.6407e-05 1.6276e-03 -6.0000e+00 3.1824e-03 1.7086e-02 -1.6454e-05 6.9917e-06 1.9848e-05 -6.0000e+00 2.1893e-04 -5.2929e-04 -1.4266e-05 10 0 0 10 0 0 99.42 20.73 0.30 -0.00053 -0.00065 730 171 1 5 0 66.550 25.79 19.93 20.73 11.45 5.3 932.17 -36 -914 -912 -2387 -3160 -2486 -1623 18 332 -460 -1863 -1390 -373 -181 579 301 39 595 981 1113 1335 651 1235 1143 589 460 -47 -649 -235 -78 873 807 1435 4 -2242 -1721 -1948 -974 -174 -237 -720 -669 -538 -675 -199 -171 -524 -409 -587 -316 484 760 716 1011 681 857 1000 385 582 462 909 1261 1337 1324 438 -233 -238 -415 475 843 69 5 -79 107 77 -219 -391 -755 -632 -524 -1023 -1218 -1732 -1764 -913 -749 -254 -7 62 373 338 549 -28 579 664 302 314 479 278 -187 -269 -681 -491 150 -432 -969 -551 -613 -191 332 309 278 193 304 114 341 324 249 110 69 -342 -6 108 145 453 583 156 910 587 271 252 -159 -139 26 65 -78 -168 73 -49 -210 -69 -415 -549 -8 -212 -220 -564 -727 -517 -338 4 85 -117 -482 -353 -101 -56 202 109 15 231 394 461 567 277 521 503 257 210 -22 -290 -103 -33 369 343 654 2 -1070 -769 -907 -514 -102 -155 -499 -490 -385 -491 -143 -123 -394 -298 -417 -220 345 578 548 810 539 690 820 319 473 370 737 1079 1182 1256 409 -216 -211 -347 405 765 67 6 -82 109 74 -201 -337 -635 -532 -462 -976 -1233 -1816 -1940 -1012 -891 -308 -9 75 462 392 631 -29 591 695 331 365 591 358 -244 -346 -808 -565 172 -519 -1254 -714 -830 -259 459 451 403 283 431 154 442 409 325 148 95 -479 -9 153 198 609 774 197 1159 756 361 343 -223 -197 38 97 -119 -265 114 -77 -328 -107 -627 -835 SS 20250205T180043.2Z 9167.750500 269 1 48.73 2 55.44 191.52 69.17 78.09 0.00 1 0.00 1 0 17 8.040e-03 5.534e-03 5.948e-04 3.199e-04 2.283946e-01 1.610729e-04 2.767927e-03 -6.000000e+00 4.541847e-03 224.63 -2.00 3.47 -2.00 315.89 0.00e+00 3.713920e-04 1.638753e-05 3.099918e-05 -6.000000e+00 1.970267e-04 276.38 -2.00 20.00 -2.00 315.33 0.00e+00 1.758 0.000 302.00 328.00 3 1.9238e+00 4.1397e-04 2.0755e-02 -6.0000e+00 1.1232e-02 3.1188e-03 4.6208e-04 1.1444e-02 -6.0000e+00 1.2216e-02 -4.6334e-03 2.6748e-04 5.6819e-03 -6.0000e+00 7.2690e-03 -1.2464e-03 1.2401e-04 1.6457e-03 -6.0000e+00 3.1082e-03 1.0549e-02 -6.9974e-05 8.9700e-06 1.9577e-05 -6.0000e+00 2.1382e-04 -8.3608e-04 -2.0671e-05 11 1 0 11 8 0 99.11 20.80 0.29 -0.00084 -0.00136 470 110 1 5 0 103.450 25.79 19.91 20.80 12.28 5.4 937.86 68 -826 -736 -1979 -3284 -2355 -1471 244 398 -278 -1719 -1427 -476 -176 479 435 34 747 930 1040 1382 718 1117 975 499 259 -151 -610 -240 64 804 947 1202 -2 -2251 -1686 -1909 -997 -110 -295 -698 -544 -560 -640 -206 -151 -495 -470 -507 -374 506 707 765 1021 649 882 948 364 489 484 977 1258 1399 1290 405 -311 -255 -420 497 810 51 54 -80 95 78 -179 -384 -806 -752 -523 -1157 -1190 -1767 -1754 -918 -774 -215 21 119 399 334 539 15 493 663 349 302 475 263 -180 -229 -656 -473 177 -384 -962 -564 -589 -240 327 271 310 197 285 163 331 353 250 112 56 -314 -21 92 125 430 510 164 912 572 273 216 -155 -190 92 47 -64 -146 47 -42 -225 -43 -390 -539 14 -198 -184 -484 -725 -469 -293 53 98 -74 -462 -377 -124 -52 160 150 12 279 360 415 565 295 455 414 211 115 -68 -263 -102 26 329 416 531 -1 -1039 -781 -860 -509 -62 -187 -469 -386 -410 -476 -152 -111 -361 -333 -349 -253 350 522 568 795 526 726 796 308 407 396 810 1046 1262 1191 385 -281 -220 -361 434 752 51 54 -82 94 76 -168 -340 -661 -619 -450 -1078 -1231 -1890 -1882 -1035 -899 -265 26 148 482 394 605 16 515 677 391 359 573 344 -230 -289 -793 -555 207 -470 -1216 -743 -780 -330 458 387 455 282 396 216 420 455 320 148 79 -447 -29 128 173 588 664 211 1138 752 372 299 -222 -275 132 72 -98 -227 74 -67 -357 -69 -598 -804 SS 20250205T180731.3Z 9167.755224 273 1 49.06 2 55.73 193.47 67.90 79.00 0.00 1 0.00 1 0 17 8.094e-03 5.520e-03 1.022e-03 5.261e-04 2.297097e-01 2.641194e-04 2.780024e-03 -6.000000e+00 4.573169e-03 224.63 -2.00 3.47 -2.00 315.99 0.00e+00 3.969724e-04 2.744645e-05 3.285771e-05 -6.000000e+00 1.983455e-04 276.38 -2.00 20.00 -2.00 315.43 0.00e+00 1.770 0.000 302.00 328.00 3 2.8801e+00 6.7957e-04 2.0896e-02 -6.0000e+00 1.1309e-02 5.2403e-03 7.5979e-04 1.1515e-02 -6.0000e+00 1.2299e-02 -3.6036e-03 4.4035e-04 5.7185e-03 -6.0000e+00 7.3189e-03 -1.6507e-03 2.0503e-04 1.6633e-03 -6.0000e+00 3.1300e-03 3.9899e-03 8.3257e-05 1.4745e-05 1.9794e-05 -6.0000e+00 2.1525e-04 -1.0888e-03 1.4590e-05 10 0 0 10 0 0 99.94 20.85 0.33 -0.00109 -0.00046 190 45 1 5 0 255.510 25.79 20.12 20.85 12.57 5.4 938.52 224 -964 -595 -2429 -2746 -2484 -1239 59 329 -340 -1925 -1234 -341 -77 463 172 -154 512 1022 1273 1318 490 1174 1055 580 626 -209 -379 -162 -60 947 889 1463 -51 -2391 -1762 -1977 -929 -229 -255 -784 -672 -628 -804 -136 -271 -462 -363 -496 -300 640 879 707 983 649 870 933 325 536 550 929 1284 1273 1327 481 -212 -253 -402 509 736 64 2 -108 113 52 -154 -326 -717 -848 -547 -1109 -1250 -1707 -1722 -873 -723 -205 -51 159 379 303 639 59 476 674 334 347 425 359 -196 -247 -733 -465 148 -469 -991 -521 -601 -180 345 266 296 145 261 128 346 344 243 95 79 -291 -33 107 146 427 437 94 876 603 280 266 -212 -161 43 106 -74 -130 85 -66 -215 -28 -318 -583 44 -216 -138 -556 -563 -462 -230 12 75 -84 -484 -304 -90 -21 145 60 -57 193 370 475 506 189 448 419 246 277 -94 -164 -65 -23 363 366 649 -24 -1114 -767 -897 -446 -131 -162 -525 -475 -458 -596 -100 -199 -336 -256 -340 -203 441 646 522 761 522 712 779 274 444 448 765 1058 1140 1211 453 -200 -216 -343 442 679 63 2 -109 111 50 -144 -287 -585 -695 -468 -1024 -1281 -1805 -1909 -971 -826 -248 -64 194 470 353 707 62 493 714 369 407 527 461 -256 -320 -873 -539 172 -565 -1285 -675 -814 -243 493 386 441 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