File name: Pandora69s1_NewBrunswickNJ_20240211_L2Fit_fout2c23d20210421p1-8.txt File generation date: 20240212T051424.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c23p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 69 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora69_OF_v2d20210223.txt Instrument calibration file used: Pandora69s1_CF_v23d20210421.txt Level 1 file used: Pandora69s1_NewBrunswickNJ_20240211_L1_smca1c23d20210421p1-8.txt Full location name: Rutgers NJDEP (USEPA AQS ID 34-023-0011) Short location name: NewBrunswickNJ Country of location: USA Location latitude [deg]: 40.4622 Location longitude [deg]: -74.4294 Location altitude [m]: 19 Local noon date: 20240211 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: based on s13, field cal for NewBrunswick, revisited HCHO First and last pixel inside fitting window: 259 400 Nominal wavelengths inside fitting window [nm]: 305.1248 305.2657 305.4066 305.5475 305.6883 305.8292 305.9700 306.1109 306.2517 306.3925 306.5333 306.6741 306.8148 306.9556 307.0963 307.2371 307.3778 307.5185 307.6592 307.7999 307.9406 308.0812 308.2219 308.3625 308.5032 308.6438 308.7844 308.9250 309.0656 309.2062 309.3467 309.4873 309.6278 309.7683 309.9089 310.0494 310.1898 310.3303 310.4708 310.6113 310.7517 310.8921 311.0326 311.1730 311.3134 311.4537 311.5941 311.7345 311.8748 312.0152 312.1555 312.2958 312.4361 312.5764 312.7167 312.8570 312.9972 313.1375 313.2777 313.4179 313.5581 313.6983 313.8385 313.9787 314.1189 314.2590 314.3991 314.5393 314.6794 314.8195 314.9596 315.0997 315.2397 315.3798 315.5198 315.6599 315.7999 315.9399 316.0799 316.2199 316.3598 316.4998 316.6397 316.7797 316.9196 317.0595 317.1994 317.3393 317.4792 317.6190 317.7589 317.8987 318.0386 318.1784 318.3182 318.4580 318.5978 318.7375 318.8773 319.0170 319.1568 319.2965 319.4362 319.5759 319.7156 319.8552 319.9949 320.1345 320.2742 320.4138 320.5534 320.6930 320.8326 320.9722 321.1117 321.2513 321.3908 321.5303 321.6698 321.8093 321.9488 322.0883 322.2278 322.3672 322.5067 322.6461 322.7855 322.9249 323.0643 323.2037 323.3430 323.4824 323.6217 323.7611 323.9004 324.0397 324.1790 324.3183 324.4575 324.5968 324.7360 324.8753 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240211T193811.0Z 8807.818183 329 1 49.86 2 64.14 219.97 48.90 194.44 0.00 1 0.00 1 0 17 2.004e-02 5.353e-03 1.248e-02 1.886e-03 3.516796e-01 9.575043e-04 4.198714e-03 -6.000000e+00 1.154198e-02 224.78 -2.00 3.50 -2.00 318.68 0.00e+00 8.896095e-04 1.833032e-04 1.190823e-04 -6.000000e+00 4.672877e-04 275.52 -2.00 20.00 -2.00 318.37 0.00e+00 2.279 0.000 302.00 328.00 3 3.5528e+00 2.5637e-03 2.8918e-02 -6.0000e+00 2.8693e-02 5.6055e-02 2.8990e-03 1.7816e-02 -6.0000e+00 3.1273e-02 -1.1221e-02 2.0838e-03 9.0530e-03 -6.0000e+00 1.8422e-02 -2.2399e-03 1.1147e-03 2.6999e-03 -6.0000e+00 7.7966e-03 9.7902e-04 -3.2604e-04 5.7228e-05 3.1485e-05 -6.0000e+00 5.6630e-04 1.8373e-02 -8.7504e-05 10 0 0 10 0 0 99.98 22.91 0.20 0.01837 0.01592 39 8 1 5 0 1278.010 26.00 20.00 22.91 17.14 29.7 1020.50 -6170 -11400 -6509 -3478 1937 -4330 -8284 -6091 -6899 -1261 -4691 1325 -4311 1173 -414 -833 -60 -1628 1454 -1677 1217 1671 268 -1673 1159 -219 -2964 430 -1278 1607 912 576 -915 -1226 -2844 -1441 -2548 -162 -832 -999 -646 -828 -70 -1067 -473 -350 483 -318 39 226 393 1838 624 989 597 1236 98 733 341 774 1226 1993 2100 572 -128 769 -535 601 831 19 196 340 183 245 258 193 -597 -614 -743 -1495 -935 -2103 -1447 -1350 -715 -215 -251 278 473 587 405 303 255 493 258 703 833 -155 -227 11 -598 -235 318 -259 -989 -776 -496 -339 27 198 74 46 -176 -127 234 461 380 395 9 -597 -102 38 60 279 539 52 1272 877 262 -48 -9 -117 171 140 -40 -119 237 -174 -126 -8 -314 -510 -296 -612 -331 -156 77 -190 -413 -331 -412 -73 -287 86 -343 104 -42 -93 -7 -205 185 -226 160 221 38 -256 181 -36 -482 63 -188 245 154 107 -184 -242 -546 -288 -584 -43 -262 -355 -243 -324 -28 -429 -190 -140 190 -126 16 94 176 861 313 519 322 677 55 400 184 422 704 1231 1400 400 -87 489 -336 385 585 15 162 283 149 189 182 125 -369 -387 -516 -1171 -806 -1972 -1414 -1387 -776 -243 -294 328 548 643 414 291 236 468 266 796 1036 -207 -308 15 -739 -272 361 -312 -1264 -1027 -684 -488 40 316 123 76 -277 -190 329 635 535 582 13 -955 -162 60 92 406 753 71 1688 1221 391 -75 -15 -196 293 250 -75 -228 459 -342 -243 -16 -574 -911 SS 20240211T194318.2Z 8807.821738 332 1 13.98 2 64.78 221.15 49.13 196.06 0.00 1 0.00 1 0 17 3.506e-02 7.525e-03 2.340e-02 4.247e-03 3.618482e-01 2.155008e-03 4.331675e-03 -6.000000e+00 2.020073e-02 224.78 -2.00 3.50 -2.00 318.23 0.00e+00 5.853290e-05 3.695031e-04 1.102986e-04 -6.000000e+00 8.173571e-04 275.52 -2.00 20.00 -2.00 317.93 0.00e+00 2.332 0.000 302.00 328.00 3 4.0839e+00 5.7236e-03 2.9633e-02 -6.0000e+00 5.0220e-02 6.9690e-02 6.4455e-03 1.8291e-02 -6.0000e+00 5.4730e-02 -1.3886e-02 4.4190e-03 9.2513e-03 -6.0000e+00 3.2240e-02 -3.0857e-03 2.3421e-03 2.7342e-03 -6.0000e+00 1.3648e-02 5.3738e-04 -1.6775e-04 1.2614e-04 3.1560e-05 -6.0000e+00 9.9073e-04 1.8026e-02 -1.6109e-05 12 9 1 12 1 1 99.26 22.91 0.35 0.01803 0.01677 4 4 1 5 0 2794.070 26.00 19.99 22.91 17.23 29.7 1020.66 -7662 -7285 -3008 -19396 6391 -17010 -4593 -10111 -2766 -5871 -7690 -4208 -13117 7876 -6361 7500 -870 4690 1840 -2228 657 -2691 6517 -4036 2535 -1248 1293 -1735 2278 3376 -3766 2727 -456 36 943 -3415 -4023 695 -2138 -1260 -739 -1704 172 -852 1750 -578 435 -1548 -3 -257 760 1423 2318 1387 560 2047 641 1768 801 32 1137 603 2415 -154 243 316 175 108 1338 768 -549 176 472 801 -402 100 -1321 -755 -662 -1357 -1541 -2591 -1480 -1503 271 -555 -13 -115 593 734 -317 290 -404 921 -689 -46 866 534 -578 -110 156 -390 871 -820 -686 -1029 -363 -475 972 378 -381 139 -179 -73 -175 718 97 517 -300 -492 272 270 127 -72 591 -148 1693 512 875 324 -260 115 -198 460 -470 -29 442 -161 -331 -483 107 -734 -438 -443 -174 -1192 289 -994 -263 -683 -191 -428 -583 -345 -1357 778 -819 921 -122 658 276 -357 103 -440 1041 -753 467 -245 241 -312 386 602 -785 585 -108 8 207 -822 -1098 213 -788 -515 -319 -767 78 -390 785 -264 195 -702 -1 -122 381 753 1285 810 337 1241 396 1066 480 19 722 413 1746 -117 179 221 120 76 1019 640 -485 156 409 661 -310 71 -906 -524 -500 -1139 -1415 -2561 -1512 -1604 301 -644 -16 -138 700 826 -339 292 -395 916 -743 -53 1090 715 -786 -145 195 -461 1009 -1006 -880 -1367 -499 -678 1437 587 -612 221 -276 -107 -247 988 137 753 -458 -767 421 411 190 -104 822 -201 2247 712 1281 498 -415 187 -328 788 -840 -52 814 -300 -610 -868 188 -1261 SS 20240211T201246.4Z 8807.842203 349 1 50.10 2 68.69 227.66 50.91 205.10 0.00 1 0.00 1 0 17 5.138e-02 5.922e-03 3.928e-02 3.475e-03 4.164923e-01 1.781848e-03 4.899910e-03 -6.000000e+00 2.959675e-02 224.78 -2.00 3.50 -2.00 319.54 0.00e+00 1.063921e-03 4.338942e-04 1.897371e-04 -6.000000e+00 1.198056e-03 275.52 -2.00 20.00 -2.00 319.24 0.00e+00 2.727 0.000 302.00 328.00 3 3.7116e+00 4.8809e-03 3.4494e-02 -6.0000e+00 7.3578e-02 6.8397e-02 5.6361e-03 2.1208e-02 -6.0000e+00 8.0192e-02 -1.3646e-02 4.7050e-03 1.0949e-02 -6.0000e+00 4.7238e-02 -1.9403e-03 2.5381e-03 3.3510e-03 -6.0000e+00 1.9993e-02 4.9270e-04 -2.4318e-04 1.0672e-04 3.9739e-05 -6.0000e+00 1.4519e-03 1.8414e-02 -6.4165e-05 10 0 0 10 0 0 99.95 22.91 0.24 0.01841 0.01659 53 11 1 5 0 945.120 26.00 20.00 22.91 16.98 29.5 1018.21 -17109 -8059 -14540 -8267 -29569 -4845 -17966 -1225 -27171 -4873 -16716 -15538 2840 5620 -5671 -2810 -2349 -4242 669 -1482 -6968 -3126 7016 3099 -1902 -5330 -3915 2704 -2323 2379 -5231 2897 -1297 2269 -2416 -302 -2214 -2369 517 -870 -589 -2205 -826 901 -1289 1381 -1714 1434 -1488 727 -130 1740 1609 1348 1273 1396 442 123 1876 841 1436 1060 2130 1015 -751 991 333 533 319 731 372 320 -324 655 635 -215 -10 -445 63 -1933 -1014 -1645 -1267 -1256 -1115 -337 -299 670 337 934 -34 682 167 295 787 -74 467 277 50 -282 2 -787 296 -260 -1413 -669 -1123 -329 308 275 24 -9 143 -324 19 -21 611 323 62 -911 240 -50 63 360 444 612 1599 834 -106 323 19 -304 224 -2 -8 -223 379 -52 -137 -317 -151 -420 -465 -217 -414 -204 -838 -114 -523 -34 -1048 -158 -626 -655 119 272 -353 -187 -167 -326 51 -120 -596 -262 571 278 -188 -561 -398 244 -218 232 -613 349 -176 293 -313 -41 -345 -439 111 -215 -156 -618 -235 253 -373 391 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