File name: Pandora55s1_QueensNY_20220225_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T112919.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20220225_L1_smca1c19d20211111p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20220225 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: None First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20220225T191835.4Z 8091.804576 405 1 8.59 2 57.98 218.86 114.65 254.87 0.00 1 0.00 1 0 25 1.145e-02 6.739e-03 4.149e-03 2.048e-03 2.514747e-01 1.061354e-03 3.064739e-03 -6.000000e+00 6.717238e-03 225.37 -2.00 3.51 -2.00 316.14 0.00e+00 -2.991733e-05 1.147294e-04 4.512505e-05 -6.000000e+00 2.921890e-04 275.97 -2.00 20.00 -2.00 315.57 0.00e+00 1.879 0.000 302.00 328.00 3 3.2321e+00 2.7393e-03 2.2628e-02 -6.0000e+00 1.6619e-02 4.4988e-02 3.0622e-03 1.2759e-02 -6.0000e+00 1.8068e-02 -6.5063e-03 1.7681e-03 6.3232e-03 -6.0000e+00 1.0750e-02 -1.0487e-03 8.0982e-04 1.7911e-03 -6.0000e+00 4.5022e-03 2.3610e-03 -2.0210e-04 6.2917e-05 2.4450e-05 -6.0000e+00 3.4148e-04 -5.7396e-03 1.0275e-04 12 9 1 12 1 1 99.98 22.69 0.19 -0.00574 -0.00726 12 15 1 5 0 647.310 25.58 19.99 22.69 10.02 30.3 1044.17 859 -2824 -1650 -5662 -3490 1236 -3320 3229 -311 -343 -3248 2111 -1099 -42 1517 -603 -1992 -285 1654 587 1782 -160 1990 -293 684 144 445 -530 241 2027 941 1557 921 -977 -715 1782 -773 675 666 -268 -1475 -1198 -1287 -1056 -535 -193 -1329 -544 -432 489 747 661 910 1057 706 606 783 323 474 883 1434 1372 806 -46 -727 -209 -187 96 953 1022 545 -376 -365 -642 -630 180 249 471 1105 437 -218 -306 -1761 -1080 -1441 -1243 -869 -273 -570 -502 -33 -116 664 1452 1321 931 930 794 -293 -730 -598 -503 -9 804 -60 -658 -394 -705 -338 141 -41 -257 -10 -248 -118 538 1094 824 773 -214 -780 -281 -42 199 321 133 351 1420 580 643 183 146 279 26 252 -473 -252 116 -275 -534 -125 -199 -258 -81 158 -581 -345 -1186 -671 216 -614 615 -67 -77 -760 481 -273 -11 452 -197 -689 -100 590 217 664 -61 749 -116 279 61 189 -221 96 772 365 632 398 -441 -319 760 -344 324 360 -162 -969 -823 -904 -751 -379 -137 -939 -377 -295 331 512 470 674 809 556 485 637 264 385 711 1158 1139 701 -42 -680 -192 -164 82 807 910 518 -375 -370 -648 -619 168 218 393 906 374 -200 -300 -1834 -1160 -1603 -1432 -1038 -335 -707 -622 -39 -134 722 1512 1366 999 1055 956 -373 -954 -773 -626 -10 937 -71 -820 -507 -931 -457 195 -60 -379 -14 -359 -165 715 1407 1061 1019 -294 -1107 -404 -60 279 441 178 456 1795 739 842 251 205 398 37 371 -719 -393 183 -441 -860 -200 -312 -396 -123 SS 20220225T192420.1Z 8091.808566 409 1 42.43 2 58.68 220.31 115.65 255.64 0.00 1 0.00 1 0 25 8.924e-03 6.153e-03 4.348e-04 2.178e-04 2.567887e-01 1.128381e-04 3.130006e-03 -6.000000e+00 5.237670e-03 225.37 -2.00 3.51 -2.00 316.14 0.00e+00 8.155911e-05 1.216713e-05 5.125462e-05 -6.000000e+00 2.277950e-04 275.97 -2.00 20.00 -2.00 315.57 0.00e+00 1.916 0.000 302.00 328.00 3 4.6165e-01 2.9135e-04 2.3082e-02 -6.0000e+00 1.2958e-02 1.7698e-02 3.2566e-04 1.3029e-02 -6.0000e+00 1.4088e-02 -9.6177e-03 1.8769e-04 6.4529e-03 -6.0000e+00 8.3814e-03 1.1349e-03 8.5757e-05 1.8295e-03 -6.0000e+00 3.5113e-03 3.6530e-02 -2.0769e-04 6.6611e-06 2.4905e-05 -6.0000e+00 2.6620e-04 -8.5428e-03 5.1065e-05 10 0 0 10 0 0 99.97 22.69 0.21 -0.00854 -0.01010 972 184 1 5 0 43.420 25.58 20.02 22.69 10.60 30.5 1047.86 -1676 -2325 -3465 -3823 -2351 -909 296 807 630 -1115 -377 394 777 585 360 -435 -296 152 401 525 219 1148 1265 970 629 220 -691 -732 393 1410 1246 1722 1366 -1000 -530 201 340 584 636 -594 -1209 -868 -1189 -1067 -816 -703 -916 -757 -596 459 669 681 1002 803 704 607 823 320 670 823 1422 1192 1219 344 -706 -90 -200 431 1156 806 155 -275 -623 -483 -685 -164 195 603 1112 152 35 -872 -1494 -1285 -1155 -1083 -706 -520 -475 -598 -76 253 369 1173 1315 1235 837 646 -395 -420 -341 -511 43 678 -76 -664 -327 -713 -126 -78 -146 -306 -221 -112 -48 520 682 810 568 -65 -455 -234 -172 -176 375 255 706 1331 809 364 459 -37 206 104 122 -279 -130 107 -467 -363 -198 -241 -262 -88 -325 -501 -780 -831 -461 -165 54 162 141 -250 -85 90 191 164 107 -144 -104 55 142 192 82 430 477 380 262 96 -289 -313 157 536 481 710 610 -449 -233 90 148 286 348 -366 -799 -584 -832 -759 -580 -498 -644 -519 -400 317 450 486 725 614 561 476 657 259 534 647 1120 984 1038 317 -653 -80 -174 366 980 715 148 -271 -634 -485 -658 -150 168 496 930 131 33 -870 -1573 -1384 -1266 -1222 -846 -631 -589 -736 -92 294 405 1233 1365 1310 947 782 -493 -548 -437 -635 51 799 -91 -820 -426 -945 -168 -106 -211 -450 -327 -160 -68 697 893 1056 748 -90 -641 -337 -245 -252 513 343 930 1671 1025 474 637 -53 291 150 178 -431 -205 168 -754 -588 -314 -380 -400 -135 SS 20220225T192959.3Z 8091.812492 412 1 49.16 2 59.38 221.72 116.64 256.41 0.00 1 0.00 1 0 17 2.212e-02 7.378e-03 5.216e-03 1.722e-03 2.624756e-01 8.834547e-04 3.153898e-03 -6.000000e+00 1.298383e-02 225.37 -2.00 3.51 -2.00 317.22 0.00e+00 2.313777e-04 1.234589e-04 1.007317e-04 -6.000000e+00 5.645530e-04 275.97 -2.00 20.00 -2.00 316.61 0.00e+00 1.955 0.000 302.00 328.00 3 4.2111e+00 2.3149e-03 2.3563e-02 -6.0000e+00 3.2123e-02 5.2205e-02 2.6023e-03 1.3327e-02 -6.0000e+00 3.4920e-02 7.8745e-04 1.5560e-03 6.5957e-03 -6.0000e+00 2.0776e-02 -5.5701e-03 7.5336e-04 1.8993e-03 -6.0000e+00 8.7041e-03 8.0284e-04 3.4456e-04 5.3692e-05 2.4068e-05 -6.0000e+00 6.5964e-04 -5.7210e-03 2.0622e-04 11 8 0 10 0 0 99.99 22.69 0.21 -0.00572 -0.00313 149 28 1 5 0 329.890 25.58 19.99 22.69 11.01 30.5 1050.27 2450 -4281 10768 -12355 2240 2176 -318 7584 1004 -1390 -5878 2871 -3827 609 2370 968 -4647 -6517 2135 2995 1118 -145 1509 -1903 1649 -1291 3476 -2631 425 -2223 2273 3134 1596 -3926 -623 5091 -399 -18 1066 576 -2659 -413 -2521 -852 -1191 491 -1621 -679 333 548 842 -54 540 1245 1955 507 1723 631 693 934 1148 2349 704 215 -687 -500 -278 -63 1159 858 276 -334 -11 -869 512 -241 579 1189 1226 174 -703 -466 -1434 -1198 -1596 -541 -1130 -207 -913 -211 -313 207 469 1021 1259 876 855 168 -55 -681 -221 -569 218 797 -43 -441 -447 -511 -65 423 -85 -451 -232 -77 -421 432 597 1180 542 -408 -508 -427 64 230 104 -64 681 1027 603 24 413 187 389 466 295 -59 -294 225 -396 -455 -169 -241 -234 -159 268 -547 1243 -1704 251 230 -35 853 133 -198 -888 409 -624 107 464 211 -1126 -1669 523 752 292 -39 400 -537 475 -398 1031 -800 120 -622 621 904 502 -1347 -205 1552 -131 -6 445 278 -1446 -233 -1495 -508 -712 290 -964 -394 189 310 486 -33 345 826 1335 358 1231 455 498 664 820 1723 554 180 -595 -425 -223 -48 885 701 246 -316 -11 -835 469 -210 461 885 903 136 -602 -432 -1433 -1249 -1743 -614 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