File name: Pandora32s1_GreenbeltMD_20240904_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240905T055601.8Z 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_20240904_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: 20240904 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 20240904T183610.8Z 9013.775125 5 1 48.74 2 38.06 218.06 39.89 188.37 0.00 1 0.00 1 0 17 7.457e-03 5.861e-03 1.468e-04 1.031e-04 1.768423e-01 5.326613e-05 2.132547e-03 -6.000000e+00 4.297062e-03 230.02 -2.00 3.47 -2.00 314.79 0.00e+00 2.468117e-04 4.471773e-06 1.639202e-05 -6.000000e+00 1.930608e-04 289.44 -2.00 20.00 -2.00 314.12 0.00e+00 1.269 0.000 302.00 328.00 3 2.1044e-01 1.3679e-04 1.5548e-02 -6.0000e+00 1.0712e-02 2.2916e-03 1.5148e-04 9.0555e-03 -6.0000e+00 1.1582e-02 -2.3267e-04 8.6783e-05 4.4202e-03 -6.0000e+00 6.9172e-03 -2.8336e-03 3.8327e-05 1.2327e-03 -6.0000e+00 2.9580e-03 1.0235e-01 -7.0361e-05 2.8703e-06 1.6145e-05 -6.0000e+00 1.9871e-04 7.7361e-03 3.4002e-05 12 1 1 12 4 4 92.60 -62.18 0.33 0.00774 0.00721 3079 722 1 5 0 15.770 27.88 19.98 -62.18 32.18 5.1 1046.25 422 -560 -352 -1784 -2488 -1578 -704 804 1159 102 -1276 -766 -84 4 560 167 -197 446 773 881 1191 339 1059 921 633 437 -66 -534 -211 150 1003 1029 1590 -122 -2228 -1643 -1772 -921 -136 -407 -908 -695 -586 -796 -282 -260 -635 -509 -600 -344 572 744 699 986 550 849 970 338 569 503 843 1185 1282 1292 379 -297 -247 -530 535 753 -10 69 -79 220 151 -100 -319 -749 -534 -475 -1103 -1181 -1799 -1733 -844 -750 -238 -71 58 351 325 580 -37 634 725 280 292 518 315 -160 -203 -681 -498 211 -415 -987 -591 -694 -257 273 233 245 223 324 173 400 344 205 148 57 -333 -45 105 151 560 578 153 995 618 367 273 -183 -176 54 46 -115 -179 91 -80 -203 -50 -434 -581 140 -207 -134 -656 -816 -502 -224 259 418 40 -497 -290 -33 2 261 80 -99 225 401 469 649 185 571 485 352 253 -39 -298 -114 76 512 556 859 -70 -1237 -906 -961 -567 -89 -298 -704 -565 -489 -672 -236 -216 -520 -401 -478 -267 451 592 588 863 476 744 863 303 501 438 744 1103 1231 1264 378 -290 -227 -459 470 708 -10 73 -82 231 150 -95 -281 -638 -453 -422 -1058 -1198 -1889 -1901 -937 -895 -290 -87 71 436 378 660 -40 659 736 310 329 618 390 -199 -249 -802 -571 244 -502 -1240 -746 -913 -338 377 326 348 307 429 225 497 418 248 191 77 -455 -62 140 201 729 715 187 1173 763 467 351 -242 -235 74 65 -165 -265 133 -118 -299 -74 -619 -836 SS 20240904T184134.3Z 9013.778870 8 1 48.86 2 38.72 219.94 40.08 190.42 0.00 1 0.00 1 0 17 7.450e-03 5.845e-03 1.441e-04 1.011e-04 1.785597e-01 5.230672e-05 2.156461e-03 -6.000000e+00 4.292434e-03 230.02 -2.00 3.47 -2.00 314.79 0.00e+00 2.555248e-04 4.384632e-06 1.708355e-05 -6.000000e+00 1.928663e-04 289.44 -2.00 20.00 -2.00 314.12 0.00e+00 1.281 0.000 302.00 328.00 3 1.6067e-01 1.3428e-04 1.5700e-02 -6.0000e+00 1.0701e-02 3.1314e-03 1.4879e-04 9.1564e-03 -6.0000e+00 1.1570e-02 -4.4254e-04 8.5260e-05 4.4699e-03 -6.0000e+00 6.9099e-03 -2.6666e-03 3.7632e-05 1.2469e-03 -6.0000e+00 2.9547e-03 1.0596e-01 -1.5326e-04 2.8207e-06 1.6287e-05 -6.0000e+00 1.9853e-04 7.9020e-03 1.8375e-05 12 1 1 12 4 4 82.51 -62.18 0.33 0.00790 0.00675 3095 726 1 5 0 15.690 27.88 19.98 -62.18 32.49 5.1 1048.92 503 -575 -350 -1793 -2494 -1538 -757 797 1165 76 -1329 -805 -47 -29 525 182 -194 509 749 944 1154 377 1044 930 592 443 -67 -529 -222 161 1000 1022 1581 -109 -2207 -1645 -1778 -941 -127 -381 -842 -712 -579 -789 -291 -245 -584 -490 -571 -358 602 779 676 990 560 849 964 345 536 483 868 1183 1268 1317 370 -301 -257 -505 517 770 -3 65 -77 192 161 -102 -325 -765 -557 -461 -1095 -1160 -1797 -1708 -862 -758 -230 -59 73 344 315 558 -29 626 710 287 304 506 317 -129 -217 -678 -502 187 -434 -967 -583 -692 -253 260 232 239 248 341 209 396 328 238 136 48 -331 -41 111 139 556 611 171 979 625 352 244 -179 -184 42 44 -118 -181 85 -77 -193 -43 -446 -585 166 -212 -133 -658 -816 -488 -241 256 420 29 -518 -305 -19 -12 245 87 -97 258 389 504 594 194 565 491 330 257 -39 -296 -121 83 513 555 858 -63 -1231 -913 -969 -583 -83 -280 -656 -582 -485 -639 -245 -205 -481 -388 -458 -280 478 625 573 835 489 750 865 312 476 423 772 1063 1229 1300 373 -296 -238 -441 459 731 -3 67 -80 196 162 -98 -290 -658 -477 -414 -1063 -1190 -1909 -1895 -968 -881 -273 -73 91 417 371 618 -30 631 731 309 347 612 398 -163 -269 -809 -561 210 -512 -1185 -744 -890 -337 351 329 333 346 458 265 480 404 292 172 63 -458 -57 149 187 708 766 211 1169 753 455 318 -240 -250 56 62 -171 -263 127 -116 -288 -62 -645 -824 SS 20240904T184656.4Z 9013.782597 11 1 48.75 2 39.41 221.75 40.30 192.44 0.00 1 0.00 1 0 17 7.465e-03 5.834e-03 1.512e-04 1.052e-04 1.801080e-01 5.440818e-05 2.171498e-03 -6.000000e+00 4.302434e-03 230.02 -2.00 3.47 -2.00 314.83 0.00e+00 2.552855e-04 4.599004e-06 1.744140e-05 -6.000000e+00 1.932772e-04 289.44 -2.00 20.00 -2.00 314.15 0.00e+00 1.293 0.000 302.00 328.00 3 2.2229e-01 1.3973e-04 1.5843e-02 -6.0000e+00 1.0726e-02 3.0321e-03 1.5485e-04 9.2293e-03 -6.0000e+00 1.1596e-02 -4.5707e-04 8.8721e-05 4.5042e-03 -6.0000e+00 6.9256e-03 -2.6787e-03 3.9216e-05 1.2572e-03 -6.0000e+00 2.9619e-03 9.8131e-02 7.5373e-05 2.9332e-06 1.6341e-05 -6.0000e+00 1.9892e-04 7.4038e-03 5.6470e-05 12 1 1 12 12 4 98.82 -62.18 0.32 0.00740 0.00797 2902 681 1 5 0 16.730 27.88 19.99 -62.18 32.69 5.1 1048.43 466 -569 -365 -1808 -2487 -1584 -772 796 1139 141 -1347 -812 -123 -54 480 219 -158 412 784 961 1171 379 1061 921 583 460 -51 -524 -178 189 1012 1020 1603 -97 -2192 -1652 -1812 -972 -165 -383 -853 -703 -541 -796 -264 -227 -588 -481 -570 -339 586 763 698 988 563 845 969 338 548 504 859 1164 1271 1305 394 -288 -221 -515 521 755 -14 50 -89 204 179 -95 -342 -746 -529 -461 -1070 -1189 -1797 -1712 -842 -760 -251 -47 75 335 316 561 -34 629 715 283 300 516 322 -165 -206 -680 -514 201 -422 -974 -579 -695 -269 270 230 236 233 338 192 396 331 242 152 60 -326 -38 104 146 546 587 157 1006 623 377 269 -179 -175 47 39 -102 -181 74 -77 -205 -65 -432 -589 151 -206 -136 -654 -802 -495 -242 252 405 54 -517 -303 -49 -22 222 104 -78 207 403 507 595 193 568 481 322 265 -30 -290 -96 96 514 550 863 -55 -1214 -910 -981 -598 -108 -280 -660 -571 -451 -672 -220 -189 -482 -379 -454 -264 463 609 589 829 488 743 867 305 485 440 761 1041 1227 1284 396 -283 -205 -449 461 715 -14 51 -93 207 179 -90 -304 -641 -453 -413 -1036 -1218 -1906 -1898 -944 -883 -309 -58 94 406 371 621 -37 634 735 305 342 623 403 -209 -256 -810 -574 227 -499 -1194 -739 -893 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