File name: Pandora55s1_QueensNY_20240527_L2Fit_fout2c17d20220526p1-8.txt File generation date: 20240528T050056.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c17p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v17d20220526.txt Level 1 file used: Pandora55s1_QueensNY_20240527_L1_smca1c17d20220526p1-8.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: 20240527 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1320 305.2720 305.4120 305.5520 305.6920 305.8320 305.9719 306.1119 306.2518 306.3917 306.5317 306.6716 306.8115 306.9514 307.0912 307.2311 307.3709 307.5108 307.6506 307.7905 307.9303 308.0701 308.2099 308.3496 308.4894 308.6292 308.7689 308.9087 309.0484 309.1881 309.3278 309.4675 309.6072 309.7469 309.8866 310.0262 310.1659 310.3055 310.4451 310.5847 310.7243 310.8639 311.0035 311.1431 311.2827 311.4222 311.5618 311.7013 311.8408 311.9803 312.1198 312.2593 312.3988 312.5383 312.6777 312.8172 312.9566 313.0960 313.2355 313.3749 313.5143 313.6536 313.7930 313.9324 314.0717 314.2111 314.3504 314.4897 314.6291 314.7684 314.9077 315.0469 315.1862 315.3255 315.4647 315.6040 315.7432 315.8824 316.0216 316.1608 316.3000 316.4392 316.5783 316.7175 316.8566 316.9958 317.1349 317.2740 317.4131 317.5522 317.6913 317.8303 317.9694 318.1085 318.2475 318.3865 318.5255 318.6645 318.8035 318.9425 319.0815 319.2205 319.3594 319.4984 319.6373 319.7762 319.9151 320.0540 320.1929 320.3318 320.4707 320.6095 320.7484 320.8872 321.0260 321.1649 321.3037 321.4425 321.5812 321.7200 321.8588 321.9975 322.1363 322.2750 322.4137 322.5524 322.6911 322.8298 322.9685 323.1072 323.2458 323.3845 323.5231 323.6617 323.8003 323.9389 324.0775 324.2161 324.3547 324.4932 324.6318 324.7703 324.9089 --------------------------------------------------------------------------------------- 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 20240527T141040.9Z 8913.590751 333 1 50.18 2 39.19 107.04 104.03 247.08 0.00 1 0.00 1 0 25 1.010e-02 6.416e-03 1.706e-03 9.827e-04 2.120921e-01 5.248507e-04 2.549811e-03 -6.000000e+00 6.088940e-03 231.87 -2.00 3.51 -2.00 315.69 0.00e+00 -8.723828e-05 5.181911e-05 4.029156e-05 -6.000000e+00 2.683077e-04 284.95 -2.00 20.00 -2.00 314.99 0.00e+00 1.289 0.000 302.00 328.00 3 4.2145e+00 1.3648e-03 1.7110e-02 -6.0000e+00 1.5254e-02 1.9190e-02 1.5143e-03 1.1012e-02 -6.0000e+00 1.6473e-02 3.5261e-03 8.6597e-04 5.3559e-03 -6.0000e+00 9.7941e-03 -3.3813e-03 3.8689e-04 1.4661e-03 -6.0000e+00 4.1178e-03 1.6738e-03 4.3004e-04 3.0218e-05 2.0453e-05 -6.0000e+00 3.0362e-04 1.1361e-02 0.0000e+00 12 9 1 12 12 4 100.00 16.26 0.15 0.01136 0.01459 71 13 1 5 0 706.660 26.11 19.98 16.26 28.27 37.5 1100.00 -3133 239 -4861 -2138 644 720 3677 897 -622 -1333 166 636 -2799 1989 -410 -1352 1544 1441 1086 -737 966 1156 -292 285 173 983 -487 112 965 1441 1742 1004 -1162 -871 1012 -147 -308 668 -296 -1502 -908 -1429 -1224 -1017 -125 -1519 -515 -633 537 98 564 381 1240 1065 605 956 429 789 862 1380 1522 1183 91 -428 -598 20 19 1028 746 74 -23 -410 -457 -395 -300 203 788 1034 255 -173 -448 -1588 -1204 -1166 -921 -901 -435 -331 -558 -66 133 231 1023 1070 1322 622 782 -289 -426 -452 -527 -6 913 20 -630 -270 -693 -77 158 84 -387 -57 -134 -96 322 487 769 569 56 -647 -343 -68 -135 153 246 220 1257 808 282 504 19 330 176 247 -312 36 153 -255 -626 -150 -253 -320 -71 -800 61 -1265 -505 140 157 842 230 -171 -372 46 184 -908 681 -154 -535 612 586 453 -317 414 496 -129 131 82 467 -229 50 411 612 766 468 -567 -421 469 -69 -158 383 -190 -1055 -666 -1077 -933 -775 -95 -1149 -381 -459 382 71 418 294 985 869 504 806 365 666 721 1158 1307 1063 86 -414 -570 18 16 880 671 71 -24 -423 -471 -397 -288 183 668 855 218 -159 -438 -1647 -1292 -1295 -1061 -1080 -536 -414 -696 -80 155 255 1069 1098 1393 695 924 -363 -548 -579 -652 -7 1050 24 -775 -343 -907 -104 217 119 -563 -83 -191 -132 420 613 962 727 74 -897 -483 -95 -187 207 324 282 1553 997 358 663 25 453 244 350 -455 54 233 -394 -976 -232 -385 -476 -105 SS 20240527T142011.4Z 8913.597354 336 1 8.41 2 37.48 109.30 105.61 248.42 0.00 1 0.00 1 0 17 8.218e-03 6.303e-03 1.005e-03 6.417e-04 2.069899e-01 3.439666e-04 2.503246e-03 -6.000000e+00 4.958077e-03 231.87 -2.00 3.51 -2.00 315.32 0.00e+00 2.250618e-05 3.146518e-05 4.181420e-05 -6.000000e+00 2.184221e-04 284.95 -2.00 20.00 -2.00 314.65 0.00e+00 1.259 0.000 302.00 328.00 3 1.7144e+00 8.9042e-04 1.6712e-02 -6.0000e+00 1.2421e-02 3.1875e-03 9.8609e-04 1.0754e-02 -6.0000e+00 1.3412e-02 3.6973e-04 5.6273e-04 5.2348e-03 -6.0000e+00 7.9743e-03 -1.7162e-03 2.4791e-04 1.4400e-03 -6.0000e+00 3.3541e-03 2.1368e-02 5.5641e-04 1.9620e-05 2.0386e-05 -6.0000e+00 2.4716e-04 9.0717e-03 0.0000e+00 12 1 1 12 5 5 99.96 16.28 0.20 0.00907 0.01325 102 117 1 5 0 81.610 26.11 19.98 16.28 29.22 37.3 1100.00 -1342 -3037 -2789 -1685 38 548 1099 639 -580 -385 1014 1208 652 443 -600 -339 -275 415 198 -125 1120 1270 957 719 331 -637 -412 322 1549 1462 1768 1477 -915 -673 114 227 336 314 -786 -1314 -1151 -1352 -1143 -938 -806 -1047 -858 -691 339 629 583 694 705 618 488 887 406 584 806 1343 1121 1100 462 -559 -141 109 492 1271 763 137 -271 -662 -474 -811 -98 145 571 1085 342 136 -681 -1396 -1213 -1040 -1025 -628 -513 -341 -627 -111 118 247 1194 1305 1187 830 713 -218 -427 -379 -457 29 777 -16 -641 -252 -735 -110 -114 -116 -304 -301 -157 -121 419 687 731 694 0 -500 -355 -301 -258 223 254 475 1328 993 452 524 51 182 137 277 -194 -181 121 -387 -409 -272 -263 -362 25 -392 -933 -825 -483 10 142 309 187 -184 -123 320 401 242 174 -261 -147 -122 189 93 -60 537 610 474 354 171 -335 -209 161 724 679 861 770 -481 -348 59 114 187 195 -524 -945 -886 -1034 -887 -728 -622 -800 -666 -519 247 462 449 541 578 526 408 752 349 497 676 1176 980 988 446 -542 -138 98 429 1085 703 136 -278 -681 -483 -829 -96 133 497 902 299 127 -681 -1474 -1309 -1139 -1155 -753 -626 -427 -782 -133 135 276 1259 1335 1271 937 826 -268 -552 -484 -569 34 885 -18 -789 -317 -940 -145 -153 -160 -435 -433 -217 -161 544 865 909 867 0 -672 -492 -416 -359 296 332 608 1608 1197 572 681 67 247 189 382 -274 -268 180 -590 -629 -412 -399 -530 35 SS 20240527T143319.0Z 8913.606470 343 1 50.69 2 35.15 112.65 107.82 250.27 0.00 1 0.00 1 0 17 8.003e-03 5.935e-03 4.382e-04 2.678e-04 2.000061e-01 1.433966e-04 2.408514e-03 -6.000000e+00 4.829936e-03 231.88 -2.00 3.51 -2.00 315.47 0.00e+00 -3.563440e-06 1.353301e-05 3.586892e-05 -6.000000e+00 2.127356e-04 284.95 -2.00 20.00 -2.00 314.79 0.00e+00 1.222 0.000 302.00 328.00 3 1.7450e+00 3.7223e-04 1.6184e-02 -6.0000e+00 1.2100e-02 -4.7934e-05 4.1255e-04 1.0386e-02 -6.0000e+00 1.3064e-02 3.6425e-03 2.3541e-04 5.0494e-03 -6.0000e+00 7.7673e-03 -3.1625e-03 1.0425e-04 1.3836e-03 -6.0000e+00 3.2684e-03 2.1789e-02 7.2783e-04 8.2419e-06 1.9674e-05 -6.0000e+00 2.4070e-04 6.6380e-03 0.0000e+00 12 1 1 12 4 4 100.00 16.46 0.23 0.00664 0.01211 1134 214 1 5 0 44.490 26.11 19.99 16.46 29.94 37.6 1100.00 -1769 -2756 -3071 -1481 -96 985 1157 1126 -331 51 931 1014 587 386 -378 -547 -291 287 525 -3 1059 1104 913 524 228 -513 -632 425 1404 1280 1564 1573 -860 -591 87 156 271 297 -697 -1324 -1081 -1227 -1117 -935 -776 -1078 -812 -669 359 590 544 869 752 628 566 811 395 706 848 1410 1167 1161 547 -545 -108 -97 237 1122 798 194 -205 -584 -403 -679 -158 179 429 1094 129 42 -712 -1376 -1212 -1006 -986 -711 -421 -347 -506 -111 202 209 1027 1179 1118 831 738 -226 -367 -291 -490 -53 608 78 -679 -212 -686 -89 -25 -7 -171 -152 -57 -135 406 548 695 623 -21 -473 -433 -188 -250 197 168 408 1211 827 352 513 5 205 69 191 -262 -143 200 -361 -328 -167 -220 -294 -76 -487 -791 -854 -399 -24 239 305 307 -98 15 274 314 203 140 -151 -232 -126 128 240 -1 496 518 413 250 114 -260 -310 194 639 578 738 742 -433 -293 41 75 144 175 -460 -936 -817 -964 -891 -746 -615 -846 -618 -492 256 423 409 690 597 517 478 695 343 606 718 1195 1030 1043 528 -525 -106 -87 208 963 738 190 -208 -616 -423 -685 -155 166 360 920 108 39 -707 -1429 -1278 -1116 -1117 -858 -512 -434 -630 -133 233 229 1068 1186 1175 912 855 -277 -472 -369 -611 -64 700 93 -837 -265 -902 -117 -35 -9 -247 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