File name: Pandora69s1_NewBrunswickNJ_20211115_L2Fit_fout2c23d20210421p1-8.txt File generation date: 20250604T192637.0Z 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 v1.8.75 Instrument operation file used: Pandora69_OF_v2d20210223.txt Instrument calibration file used: Pandora69s1_CF_v23d20210421.txt Level 1 file used: Pandora69s1_NewBrunswickNJ_20211115_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: 20211115 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 20211115T134411.2Z 7989.572352 208 1 11.05 2 72.15 135.70 139.08 351.56 0.00 1 0.00 1 0 25 1.097e-01 6.916e-03 7.706e-02 4.477e-03 4.929317e-01 2.290691e-03 5.824577e-03 -6.000000e+00 6.297891e-02 223.33 -2.00 3.50 -2.00 319.50 0.00e+00 1.284544e-03 5.738343e-04 2.389580e-04 -6.000000e+00 2.557927e-03 280.79 -2.00 20.00 -2.00 319.22 0.00e+00 3.218 0.001 302.00 328.00 3 2.9695e+00 6.2591e-03 4.0709e-02 -6.0000e+00 1.5608e-01 6.0129e-02 7.2956e-03 2.5068e-02 -6.0000e+00 1.7018e-01 -2.0663e-02 6.4592e-03 1.3048e-02 -6.0000e+00 1.0035e-01 6.2900e-04 3.5022e-03 4.0237e-03 -6.0000e+00 4.2693e-02 5.8730e-04 -6.8749e-04 1.3112e-04 4.6837e-05 -6.0000e+00 3.0994e-03 4.2442e-03 -1.1419e-04 12 9 1 12 1 1 99.64 22.87 0.23 0.00424 -0.00092 6 7 1 5 0 1552.200 26.00 20.00 22.87 12.26 13.5 918.46 -3538 14885 -43180 16896 -41623 -38063 -38079 -42953 41994 -36474 43232 -19229 -8912 -29827 10228 -11105 3355 6414 -13579 -5373 -6159 11451 -5560 2632 -7549 5134 -8218 337 4220 -2476 5573 5681 3598 -5628 -331 -1948 1137 757 -4244 -293 -3158 1390 -1350 240 -280 1847 1453 -1132 -547 2515 802 1155 2932 -1088 1868 576 159 646 -301 1173 724 2410 840 505 -704 1378 29 -511 1189 709 603 -263 1167 -19 376 -81 -487 210 -1078 -2231 -1753 -879 -1053 -713 -702 -1390 -162 165 1144 484 987 -40 934 681 647 300 958 67 -182 -22 -710 -291 -304 -152 -798 -983 -1362 -716 382 -157 422 51 584 25 217 70 229 -123 -23 -951 -179 253 81 513 192 241 1180 1031 413 148 515 -373 95 380 -190 -447 378 -318 -189 -555 -225 177 -54 210 -1059 221 -881 -809 -892 -1181 583 -1096 653 -595 -303 -1492 417 -621 178 356 -958 -364 -424 681 -415 195 -652 410 -737 27 321 -220 524 601 427 -730 -39 -246 158 125 -878 -67 -798 353 -363 64 -76 498 397 -321 -159 758 268 415 1110 -452 782 251 70 280 -129 501 328 1172 454 290 -403 748 16 -290 732 483 434 -194 829 -13 235 -47 -272 121 -692 -1627 -1414 -763 -961 -680 -707 -1466 -174 179 1219 496 949 -37 835 633 654 335 1171 89 -245 -29 -887 -339 -345 -179 -991 -1264 -1833 -1005 563 -247 689 84 939 39 322 102 339 -189 -37 -1554 -288 398 126 763 278 340 1641 1503 646 245 889 -666 173 721 -375 -905 770 -656 -385 -1100 -431 331 SS 20211115T142327.9Z 7989.599629 230 1 3.02 2 67.35 144.20 139.08 5.98 0.00 1 0.00 1 0 17 4.021e-02 8.369e-03 3.058e-02 5.149e-03 4.020019e-01 2.613893e-03 4.817206e-03 -6.000000e+00 2.309577e-02 223.33 -2.00 3.50 -2.00 318.14 0.00e+00 -1.666911e-05 4.420307e-04 1.237738e-04 -6.000000e+00 9.375240e-04 280.79 -2.00 20.00 -2.00 317.85 0.00e+00 2.575 0.000 302.00 328.00 3 2.6905e+00 6.9168e-03 3.2704e-02 -6.0000e+00 5.7243e-02 4.2430e-02 7.7851e-03 2.0159e-02 -6.0000e+00 6.2388e-02 -1.4194e-02 5.3600e-03 1.0249e-02 -6.0000e+00 3.6785e-02 2.2496e-03 2.8603e-03 3.0527e-03 -6.0000e+00 1.5666e-02 1.6305e-03 4.4778e-04 1.5017e-04 3.5000e-05 -6.0000e+00 1.1353e-03 1.4399e-03 6.7947e-05 12 9 1 12 1 1 999.00 22.88 0.26 0.00144 0.00480 2 11 1 5 0 946.240 26.00 20.00 22.88 12.42 13.5 920.22 -4625 -24758 21997 -13783 1573 -9241 -1406 -1616 -12782 -3957 -13092 3609 -8837 -743 -7118 7015 5750 -7019 366 -2135 3567 -67 39 355 -1190 -315 -1859 1125 -2382 -963 3250 1386 -2435 1728 1480 -2149 310 -1786 -1010 -2239 -502 -2649 1264 776 -583 -174 -1157 62 -354 490 98 1309 2608 1609 868 1099 1896 -95 1918 825 2208 287 2522 472 -72 305 -20 695 283 -814 -176 1028 -843 550 -84 537 130 -281 672 -1304 -1571 -2262 -1728 -1671 -1231 -1312 -93 -189 -16 -169 584 505 119 1822 543 305 1144 390 -92 -516 -145 -931 1006 -321 -910 -222 -564 -822 -94 -27 268 48 352 199 -300 650 1029 152 139 -1663 -242 0 538 -36 949 180 1379 1463 774 -408 -312 743 -324 445 57 -754 132 -474 339 -308 -186 -672 -232 -1614 939 -753 70 -467 -73 -94 -904 -268 -991 261 -837 -76 -891 850 747 -1082 55 -339 543 -11 7 63 -227 -62 -363 202 -432 -183 655 310 -607 415 341 -532 84 -567 -371 -929 -218 -1211 573 355 -270 -80 -537 28 -165 237 51 710 1475 958 532 686 1187 -60 1172 511 1410 198 1830 360 -54 221 -15 504 221 -693 -156 917 -748 465 -67 397 93 -203 520 -1120 -1465 -2251 -1781 -1785 -1373 -1516 -110 -224 -19 -192 626 518 119 1843 589 357 1432 519 -124 -682 -184 -1124 1180 -393 -1164 -291 -766 -1157 -138 -41 421 75 540 294 -427 905 1449 222 210 -2589 -373 0 798 -51 1330 247 1860 2038 1137 -630 -497 1201 -537 757 100 -1360 240 -871 615 -547 -322 -1145 SS 20211115T142843.1Z 7989.603276 233 1 49.95 2 66.77 145.40 138.95 7.89 0.00 1 0.00 1 0 17 1.181e-01 9.925e-03 1.142e-01 8.877e-03 4.016139e-01 4.545641e-03 4.758681e-03 -6.000000e+00 6.780323e-02 223.33 -2.00 3.50 -2.00 319.38 0.00e+00 4.196727e-04 1.064797e-03 1.738382e-04 -6.000000e+00 2.752714e-03 280.79 -2.00 20.00 -2.00 319.09 0.00e+00 2.516 0.000 302.00 328.00 3 5.1834e+00 1.2365e-02 3.2322e-02 -6.0000e+00 1.6805e-01 8.7944e-02 1.4221e-02 2.0297e-02 -6.0000e+00 1.8317e-01 1.5244e-02 1.1576e-02 1.0511e-02 -6.0000e+00 1.0800e-01 -1.7477e-02 6.2623e-03 3.2347e-03 -6.0000e+00 4.5983e-02 1.3737e-04 -8.7793e-05 2.7243e-04 3.8170e-05 -6.0000e+00 3.3338e-03 2.7882e-03 4.1614e-05 12 9 8 11 8 0 99.98 22.88 0.35 0.00279 0.00213 23 5 1 5 0 2171.080 26.00 20.00 22.88 12.62 13.6 923.41 45472 -35269 -26343 -6213 20827 37966 3382 71475 -32742 46039 -25482 -17788 18494 -17885 42567 -1305 -11539 -3436 -5926 -2404 1835 -10822 -1084 -2763 -1865 -3130 -3140 -4329 9411 15169 1918 4315 -1432 -1715 -8407 -6737 -2684 853 -2385 389 4884 -283 640 -2056 -5955 3229 -1274 4261 -520 8007 1463 -2075 3025 -3311 1683 -1068 3751 2220 796 1019 2281 364 3567 944 -1059 876 -147 580 1368 895 -14 1104 -1915 1143 271 -86 -2069 -5488 -811 -702 31 -2153 -1048 -1875 -607 356 -1068 1073 1229 138 -234 462 -555 1702 -1573 1208 638 975 563 263 -904 -93 -1119 -660 -282 -790 -1755 -39 -94 1001 -3 407 227 -260 -411 -746 -792 172 370 -499 46 238 510 227 1333 210 1252 786 -390 48 565 -775 212 -18 -775 840 721 -125 -25 -366 -291 -704 792 -1363 -949 -173 427 689 91 1176 -1501 1083 -1169 -848 743 -1176 1861 -94 -974 -286 -529 -215 159 -1067 -104 -287 -202 -356 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