File name: Pandora55s1_QueensNY_20210205_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T175405.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210205_L1_smca1c11d20210101p1-8.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: 20210205 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]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 20210205T160906.8Z 7706.672996 456 1 1.66 2 58.15 162.89 86.67 241.16 0.00 1 0.00 1 0 25 1.313e-02 7.184e-03 8.716e-03 3.739e-03 2.880076e-01 1.930145e-03 3.502026e-03 -6.000000e+00 7.698789e-03 224.53 -2.00 3.51 -2.00 316.50 0.00e+00 -2.786983e-04 2.271066e-04 5.192404e-05 -6.000000e+00 3.343291e-04 275.27 -2.00 20.00 -2.00 315.93 0.00e+00 1.888 0.000 302.00 328.00 3 2.5998e+00 4.9956e-03 2.3776e-02 -6.0000e+00 1.9017e-02 2.1683e-02 5.5910e-03 1.4520e-02 -6.0000e+00 2.0670e-02 -6.3812e-03 3.2630e-03 7.2364e-03 -6.0000e+00 1.2303e-02 -1.2610e-04 1.5337e-03 2.0680e-03 -6.0000e+00 5.1724e-03 4.1615e-03 3.6258e-04 1.1419e-04 2.7406e-05 -6.0000e+00 3.9120e-04 -4.3681e-03 1.8177e-04 12 9 1 12 1 1 98.05 22.81 0.19 -0.00437 -0.00164 3 26 1 5 0 370.230 25.68 19.99 22.81 11.63 26.7 1015.56 -4750 -1433 -2923 -5416 -5833 -3731 -1720 2735 -1219 -2169 1670 2825 577 1927 -1048 1353 -2154 -1167 1931 422 979 805 1455 700 1528 556 -269 -13 -21 1290 273 1746 1039 -997 -1362 653 343 100 -132 226 -2551 -728 -1279 -327 -791 -938 -596 27 256 620 401 484 1544 97 927 451 753 757 -200 492 1576 2227 603 792 -1319 -19 540 745 1548 181 392 -1071 -445 -1380 -415 -582 252 1345 973 1265 -90 -507 -1179 -1105 -974 -1321 -1254 -651 -737 -402 -161 349 410 947 1874 620 1118 354 162 -928 -124 -643 -279 726 -116 -448 -822 -481 -395 17 53 -292 -212 124 4 286 1184 1137 491 232 -280 -71 -1 -710 -155 409 134 1246 1009 800 518 -130 -152 -2 390 -270 -458 299 -512 -682 -126 9 -420 210 -725 -234 -503 -935 -949 -562 -258 427 -218 -414 317 539 120 439 -273 378 -653 -364 606 138 325 271 490 244 555 211 -104 -5 -7 451 97 648 413 -417 -572 263 141 44 -66 126 -1571 -466 -843 -218 -528 -628 -395 17 166 399 263 329 1088 71 700 348 591 596 -158 384 1226 1766 505 693 -1199 -17 465 618 1281 159 364 -1051 -443 -1377 -401 -540 220 1108 792 1064 -81 -491 -1211 -1177 -1071 -1509 -1484 -791 -908 -494 -193 401 448 992 1936 667 1267 427 205 -1222 -161 -812 -337 853 -140 -558 -1060 -635 -536 23 77 -433 -317 182 5 389 1555 1489 658 322 -402 -103 -1 -1017 -217 556 178 1607 1305 1066 718 -186 -222 -2 587 -419 -732 484 -840 -1126 -206 14 -660 325 SS 20210205T162037.8Z 7706.680993 467 1 51.53 2 57.57 166.08 88.55 243.01 0.00 1 0.00 1 0 25 9.715e-03 6.688e-03 3.839e-04 1.652e-04 2.888593e-01 8.521785e-05 3.529414e-03 -6.000000e+00 5.695536e-03 224.53 -2.00 3.51 -2.00 316.51 0.00e+00 2.451566e-05 1.007019e-05 7.291736e-05 -6.000000e+00 2.473781e-04 275.27 -2.00 20.00 -2.00 315.94 0.00e+00 1.858 0.000 302.00 328.00 3 2.0873e-01 2.2051e-04 2.3595e-02 -6.0000e+00 1.4068e-02 1.8349e-02 2.4694e-04 1.4602e-02 -6.0000e+00 1.5294e-02 -1.1284e-02 1.4411e-04 7.2776e-03 -6.0000e+00 9.1025e-03 1.1781e-03 6.7726e-05 2.0753e-03 -6.0000e+00 3.8254e-03 4.6822e-02 -1.9887e-04 5.0360e-06 2.8154e-05 -6.0000e+00 2.8950e-04 -4.5952e-03 7.1311e-05 11 8 0 10 0 0 99.94 22.82 0.23 -0.00460 -0.00609 1879 355 1 5 0 26.720 25.68 19.98 22.82 12.57 27.0 1022.35 -2293 -2445 -3645 -4140 -2687 -1355 -425 313 203 -1254 -560 627 704 599 411 -439 -339 -861 347 560 -29 973 1323 1011 596 313 -583 -657 401 1669 1551 1655 1549 -909 -732 268 350 491 519 -599 -1280 -1039 -1141 -1063 -780 -641 -913 -624 -630 431 754 575 882 719 671 571 811 241 624 844 1481 1288 1162 489 -765 -221 93 599 1481 975 113 -343 -780 -571 -814 -183 346 708 1457 408 82 -775 -1531 -1304 -1091 -1130 -813 -645 -543 -706 -215 274 400 1346 1544 1379 882 783 -361 -622 -485 -561 57 861 171 -796 -370 -760 -161 -100 -141 -373 -372 -194 -67 586 886 891 694 -44 -621 -448 -263 -285 205 269 558 1426 1118 463 478 -21 249 165 326 -240 -220 116 -432 -495 -293 -261 -295 24 -360 -398 -630 -701 -413 -208 -65 52 35 -236 -107 121 147 143 105 -127 -105 -262 109 182 -10 326 445 353 222 115 -220 -257 147 580 547 627 600 -381 -305 107 142 222 262 -341 -787 -653 -749 -712 -524 -429 -609 -407 -404 272 486 395 615 531 518 435 630 190 487 647 1131 1026 955 436 -693 -196 80 507 1244 852 106 -336 -762 -574 -784 -169 300 585 1165 349 75 -741 -1557 -1413 -1201 -1279 -944 -786 -678 -877 -255 312 431 1388 1627 1481 1010 929 -458 -807 -643 -699 70 1002 206 -996 -472 -988 -218 -139 -202 -546 -552 -287 -95 795 1171 1167 945 -62 -902 -646 -386 -408 290 362 738 1851 1457 620 665 -30 367 241 495 -375 -351 191 -706 -813 -473 -418 -468 36 SS 20210205T162510.7Z 7706.684152 470 1 51.42 2 57.37 167.36 89.30 243.73 0.00 1 0.00 1 0 25 9.749e-03 6.659e-03 4.375e-04 1.848e-04 2.877121e-01 9.533977e-05 3.513401e-03 -6.000000e+00 5.715786e-03 224.53 -2.00 3.51 -2.00 316.55 0.00e+00 -1.612257e-05 1.131714e-05 7.019900e-05 -6.000000e+00 2.482527e-04 275.27 -2.00 20.00 -2.00 315.97 0.00e+00 1.848 0.000 302.00 328.00 3 4.2232e-01 2.4679e-04 2.3480e-02 -6.0000e+00 1.4118e-02 1.9850e-02 2.7627e-04 1.4537e-02 -6.0000e+00 1.5348e-02 -1.0230e-02 1.6165e-04 7.2537e-03 -6.0000e+00 9.1347e-03 7.0115e-04 7.6133e-05 2.0736e-03 -6.0000e+00 3.8391e-03 3.8213e-02 -1.5397e-04 5.6478e-06 2.7651e-05 -6.0000e+00 2.9051e-04 -4.7353e-03 7.8927e-05 11 8 0 10 0 0 99.99 22.82 0.22 -0.00474 -0.00589 1767 334 1 5 0 28.420 25.68 20.00 22.82 13.25 27.1 1026.14 -2251 -2296 -3694 -4187 -2715 -1505 -39 -48 549 -1546 -541 331 730 561 455 -571 -552 -23 292 554 -192 1156 1254 1163 589 390 -600 -677 499 1592 1569 1540 1554 -1098 -627 195 437 514 456 -604 -1317 -1079 -1217 -1041 -822 -522 -890 -640 -691 466 752 588 815 679 622 576 848 275 625 830 1470 1260 1195 461 -750 -172 118 582 1407 1050 89 -303 -780 -535 -780 -193 349 708 1495 414 125 -796 -1494 -1356 -1094 -1097 -799 -638 -550 -677 -256 281 394 1396 1518 1389 882 803 -345 -617 -477 -570 63 850 176 -803 -347 -754 -135 -93 -116 -365 -347 -165 -67 609 867 927 675 -10 -620 -459 -286 -286 212 269 513 1426 1128 432 485 -49 261 162 309 -227 -217 133 -431 -465 -289 -262 -286 54 -343 -363 -620 -688 -439 -224 -6 -8 92 -284 -101 62 148 130 113 -160 -166 -7 89 174 -62 374 409 393 212 148 -234 -256 177 536 535 565 620 -446 -252 80 182 225 222 -332 -782 -690 -813 -673 -533 -355 -603 -424 -450 299 492 388 575 508 463 443 665 219 491 642 1133 1013 988 396 -682 -153 102 474 1138 923 84 -297 -793 -538 -752 -179 303 590 1202 341 111 -763 -1518 -1468 -1200 -1236 -957 -773 -682 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