File name: Pandora55s1_QueensNY_20220521_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T121357.1Z 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_20220521_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: 20220521 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 20220521T130839.8Z 8176.547683 279 1 13.47 2 51.30 96.01 75.36 222.09 0.00 1 0.00 1 0 17 1.646e-02 7.952e-03 6.423e-03 3.226e-03 2.317944e-01 1.704592e-03 2.769959e-03 -6.000000e+00 9.880101e-03 231.47 -2.00 3.51 -2.00 316.10 0.00e+00 4.978906e-05 1.844068e-04 5.365031e-05 -6.000000e+00 4.346765e-04 284.25 -2.00 20.00 -2.00 315.38 0.00e+00 1.596 0.000 302.00 328.00 3 4.6678e+00 4.4520e-03 2.0081e-02 -6.0000e+00 2.4731e-02 1.3784e-02 4.9565e-03 1.2023e-02 -6.0000e+00 2.6730e-02 3.4790e-03 2.8408e-03 5.8398e-03 -6.0000e+00 1.5905e-02 -4.3889e-03 1.2828e-03 1.6030e-03 -6.0000e+00 6.6311e-03 7.6219e-04 1.2604e-04 9.9164e-05 2.1509e-05 -6.0000e+00 4.9190e-04 -4.0431e-03 1.5830e-04 12 9 1 12 33 1 99.82 21.25 0.20 -0.00404 -0.00310 4 4 1 5 0 2658.370 25.68 20.01 21.25 26.59 32.4 1100.00 -3296 -802 4534 -10958 1279 408 -2825 4622 1542 -1369 1031 -306 -2125 556 3281 -1496 -3994 1612 2096 1308 1922 -29 1943 -1420 300 -904 3658 -2013 -861 665 1032 2779 668 -3772 -1888 4326 -106 -120 1362 744 -2076 -314 -2139 -1861 -1614 36 -922 -59 -182 180 -377 62 665 1291 1553 693 2050 803 540 954 1489 416 405 -623 51 -508 793 -25 1605 944 320 -511 -29 -1077 506 -788 370 985 968 -483 -707 116 -1330 -399 -1581 -745 -958 -38 -766 -711 -330 -45 599 1060 1251 625 479 642 -524 -712 -590 -735 532 1302 712 -381 -401 -1116 -139 255 33 -318 -151 -377 -172 279 639 97 617 -166 -555 -178 105 264 294 426 600 1379 472 144 414 -72 391 442 386 -268 117 113 -581 -566 -137 -451 -213 -142 -649 -168 930 -2477 242 74 -536 895 335 -321 239 -73 -545 154 984 -502 -1430 568 756 488 726 -11 743 -574 125 -392 1539 -859 -349 258 403 1121 291 -1737 -848 1808 -47 -58 738 452 -1388 -217 -1532 -1347 -1167 26 -658 -41 -125 123 -262 44 496 992 1223 557 1662 659 442 772 1211 350 357 -577 48 -471 695 -21 1351 841 305 -512 -29 -1093 496 -743 326 818 793 -414 -651 114 -1381 -428 -1762 -860 -1149 -47 -958 -885 -400 -52 653 1102 1291 670 543 773 -666 -929 -761 -914 629 1509 848 -475 -517 -1481 -189 354 47 -469 -223 -545 -239 369 817 125 808 -227 -786 -256 149 370 404 569 778 1736 598 189 562 -101 552 632 564 -404 181 178 -928 -909 -217 -706 -326 -215 SS 20220521T131631.1Z 8176.553138 285 1 13.07 2 49.82 97.44 76.32 223.62 0.00 1 0.00 1 0 25 9.978e-03 6.622e-03 3.448e-03 1.870e-03 2.247593e-01 9.902153e-04 2.705408e-03 -6.000000e+00 5.987936e-03 231.47 -2.00 3.51 -2.00 315.88 0.00e+00 5.085822e-05 1.017871e-04 4.447975e-05 -6.000000e+00 2.635129e-04 284.25 -2.00 20.00 -2.00 315.17 0.00e+00 1.547 0.000 302.00 328.00 3 3.8031e+00 2.5790e-03 1.9483e-02 -6.0000e+00 1.4988e-02 9.9360e-03 2.8678e-03 1.1685e-02 -6.0000e+00 1.6202e-02 -1.7888e-03 1.6396e-03 5.6813e-03 -6.0000e+00 9.6399e-03 -2.6737e-03 7.3184e-04 1.5585e-03 -6.0000e+00 4.0179e-03 1.9309e-03 -1.9022e-04 5.7452e-05 2.1495e-05 -6.0000e+00 2.9825e-04 -2.8882e-03 1.1745e-04 12 9 1 12 1 1 99.92 21.28 0.14 -0.00289 -0.00432 14 11 1 5 0 859.290 25.68 19.98 21.28 27.25 32.4 1100.00 -1360 -771 -944 -6290 -374 325 55 2475 51 578 -1730 1166 -820 125 471 -277 -1634 503 665 1363 368 1463 1149 179 716 -281 1013 -637 54 669 2056 2312 1046 -1918 -549 1248 -244 20 437 -624 -1221 -889 -1363 -1619 -1279 -366 -1482 -1062 -490 177 777 405 787 1043 750 212 1250 433 846 1021 1367 1499 1187 206 -513 -150 11 514 1161 1037 -95 -361 -271 -567 -529 -152 257 502 1354 -149 -113 -685 -1580 -934 -968 -1098 -743 -539 -522 -380 -289 195 359 1440 1424 920 684 530 -319 -647 -315 -664 93 957 68 -598 -269 -709 -171 175 70 -752 -209 87 30 411 494 990 588 -62 -669 -458 -161 -112 331 75 576 1233 885 408 390 222 117 82 70 -89 -203 250 -416 -390 -206 -237 -294 -81 -297 -181 -227 -1528 -80 66 11 545 13 148 -455 302 -229 38 157 -100 -618 192 260 545 151 597 473 76 315 -129 461 -286 23 275 844 990 477 -917 -256 562 -114 10 249 -396 -838 -635 -998 -1201 -947 -269 -1088 -765 -346 123 548 297 598 817 604 174 1034 361 701 841 1129 1273 1055 192 -488 -140 9 438 990 932 -91 -364 -277 -577 -525 -144 228 422 1117 -128 -104 -674 -1644 -1002 -1074 -1266 -888 -664 -651 -470 -349 225 393 1497 1468 984 773 634 -402 -837 -403 -821 110 1108 81 -743 -345 -933 -231 241 100 -1100 -306 124 42 540 628 1256 765 -84 -940 -652 -228 -156 451 100 742 1545 1113 530 524 306 165 116 101 -132 -312 389 -656 -619 -323 -366 -446 -122 SS 20220521T132201.3Z 8176.556959 288 1 49.17 2 48.79 98.46 77.01 224.68 0.00 1 0.00 1 0 17 9.357e-03 6.310e-03 1.558e-03 7.896e-04 2.196080e-01 4.168807e-04 2.640384e-03 -6.000000e+00 5.616627e-03 231.47 -2.00 3.51 -2.00 316.11 0.00e+00 -1.823045e-05 4.501467e-05 5.378768e-05 -6.000000e+00 2.471226e-04 284.25 -2.00 20.00 -2.00 315.39 0.00e+00 1.515 0.000 302.00 328.00 3 2.7742e+00 1.0891e-03 1.9069e-02 -6.0000e+00 1.4059e-02 -2.2921e-03 1.2122e-03 1.1426e-02 -6.0000e+00 1.5196e-02 1.1423e-03 6.9460e-04 5.5533e-03 -6.0000e+00 9.0416e-03 -3.7743e-03 3.1313e-04 1.5220e-03 -6.0000e+00 3.7694e-03 5.6529e-03 3.2317e-06 2.4357e-05 2.0688e-05 -6.0000e+00 2.7967e-04 -3.9903e-03 1.3949e-04 10 0 0 10 0 0 99.99 21.25 0.12 -0.00399 -0.00397 159 30 2 5 0 309.060 25.68 20.02 21.25 27.80 32.4 1100.00 -1084 -1097 -1608 -4763 -1054 105 1142 2922 1995 -123 -371 1448 692 464 925 -799 -1298 -1232 627 938 402 1025 1311 511 457 -216 -204 -915 245 918 1712 1725 1124 -1689 -679 1109 95 220 600 -492 -1564 -744 -1619 -1225 -1276 -454 -1256 -836 -599 461 660 506 896 718 793 396 962 218 811 825 1436 1356 869 104 -780 -167 51 593 1358 958 194 -216 -518 -412 -368 -131 346 898 1259 242 -92 -668 -1423 -1115 -1102 -903 -688 -342 -381 -550 -79 194 417 1242 1358 1174 729 633 -470 -511 -443 -538 145 807 39 -639 -316 -781 -122 14 -202 -437 -224 -124 -170 482 807 817 614 -101 -668 -409 -128 -231 152 100 612 1254 861 326 567 61 257 171 203 -303 -53 88 -416 -389 -237 -188 -163 -54 -216 -236 -355 -1048 -208 19 213 585 441 -29 -89 344 176 130 284 -268 -457 -445 230 352 154 394 506 204 190 -93 -89 -388 98 353 660 697 482 -761 -299 469 42 105 325 -300 -1040 -515 -1155 -883 -920 -326 -897 -585 -411 312 452 360 662 550 624 317 781 179 659 665 1162 1131 762 96 -734 -154 45 495 1132 847 184 -215 -526 -415 -362 -123 302 739 1018 205 -84 -651 -1469 -1193 -1220 -1040 -823 -420 -475 -685 -96 224 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