File name: Pandora83s1_BondvilleIL_20250721_L2Fit_fout2c3d20240316p1-8.txt File generation date: 20250722T133031.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Kevin Mishoe Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 83 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora83_OF_v4d20231115.txt Instrument calibration file used: Pandora83s1_CF_v3d20240316.txt Level 1 file used: Pandora83s1_BondvilleIL_20250721_L1_smca1c3d20240316p1-8.txt Full location name: Bondville, Illinois EPA Castnet Site Short location name: BondvilleIL Country of location: United States Location latitude [deg]: 40.0520 Location longitude [deg]: -88.3725 Location altitude [m]: 213 Local noon date: 20250721 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 199 341 Nominal wavelengths inside fitting window [nm]: 305.0622 305.2028 305.3435 305.4841 305.6247 305.7653 305.9059 306.0465 306.1871 306.3276 306.4681 306.6087 306.7492 306.8897 307.0302 307.1707 307.3112 307.4516 307.5921 307.7325 307.8730 308.0134 308.1538 308.2942 308.4346 308.5749 308.7153 308.8556 308.9960 309.1363 309.2766 309.4169 309.5572 309.6975 309.8378 309.9780 310.1183 310.2585 310.3987 310.5389 310.6791 310.8193 310.9595 311.0997 311.2398 311.3800 311.5201 311.6602 311.8003 311.9404 312.0805 312.2206 312.3606 312.5007 312.6407 312.7808 312.9208 313.0608 313.2008 313.3407 313.4807 313.6207 313.7606 313.9006 314.0405 314.1804 314.3203 314.4602 314.6001 314.7399 314.8798 315.0196 315.1595 315.2993 315.4391 315.5789 315.7187 315.8584 315.9982 316.1380 316.2777 316.4174 316.5571 316.6968 316.8365 316.9762 317.1159 317.2555 317.3952 317.5348 317.6744 317.8141 317.9537 318.0932 318.2328 318.3724 318.5119 318.6515 318.7910 318.9305 319.0700 319.2095 319.3490 319.4885 319.6280 319.7674 319.9068 320.0463 320.1857 320.3251 320.4645 320.6039 320.7432 320.8826 321.0219 321.1613 321.3006 321.4399 321.5792 321.7185 321.8577 321.9970 322.1363 322.2755 322.4147 322.5539 322.6932 322.8323 322.9715 323.1107 323.2499 323.3890 323.5281 323.6673 323.8064 323.9455 324.0846 324.2236 324.3627 324.5018 324.6408 324.7798 324.9188 --------------------------------------------------------------------------------------- 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 20250721T154208.9Z 9333.654270 322 1 1.46 2 35.38 113.58 15.33 219.81 0.00 1 0.00 1 0 17 9.259e-03 7.644e-03 6.743e-03 4.985e-03 1.674766e-01 2.615739e-03 2.049769e-03 -6.000000e+00 5.414597e-03 232.49 -2.00 3.49 -2.00 314.54 0.00e+00 5.619559e-04 2.088821e-04 6.196604e-05 -6.000000e+00 2.408694e-04 289.22 -2.00 20.00 -2.00 313.91 0.00e+00 1.226 0.000 302.00 328.00 3 3.7737e+00 6.7386e-03 1.4914e-02 -6.0000e+00 1.3581e-02 2.6098e-02 7.4362e-03 8.7626e-03 -6.0000e+00 1.4652e-02 -7.0945e-03 4.2570e-03 4.2336e-03 -6.0000e+00 8.7265e-03 -1.7984e-03 1.8585e-03 1.1693e-03 -6.0000e+00 3.7156e-03 3.1108e-03 -5.5840e-04 1.3998e-04 1.6176e-05 -6.0000e+00 2.5166e-04 -1.1374e-02 0.0000e+00 12 9 1 12 1 1 999.00 25.90 0.21 -0.01137 -0.01557 1 8 1 5 0 727.120 34.25 20.00 25.90 34.25 1.7 1100.00 228 -1734 1886 -2324 -3021 321 118 307 2641 435 -710 -165 -1574 1162 -421 71 -174 -466 1079 964 234 149 -286 1188 -207 -675 -59 -251 137 1747 257 2204 1326 -859 -1099 -799 -1221 -282 -286 -423 -673 -2105 -1585 122 -517 342 -202 -1558 -1159 -22 868 -105 144 1096 989 911 1799 475 376 309 1678 1709 1174 1407 302 -522 -46 524 260 1333 1104 -75 326 526 -156 -639 -1073 -50 -677 -1130 -2008 -1996 -1626 -1374 -874 -265 41 263 123 -677 479 390 -263 -291 81 139 1537 448 -841 -454 -458 -897 -447 -380 -648 -1281 -609 -207 523 592 214 994 534 238 743 521 291 447 297 -227 -239 67 337 -83 551 269 974 504 389 -130 167 233 -630 422 -699 313 93 -333 -576 107 84 -757 -153 90 -703 746 -895 -1108 114 40 116 1082 177 -286 -65 -683 549 -212 36 -91 -249 583 536 134 84 -162 689 -121 -407 -35 -149 75 949 144 1209 780 -528 -637 -441 -719 -180 -206 -319 -557 -1761 -1350 103 -437 285 -165 -1299 -926 -17 686 -88 122 958 888 830 1576 421 343 279 1531 1583 1128 1425 310 -498 -43 461 237 1288 1130 -78 342 538 -158 -614 -967 -43 -589 -1035 -1985 -2077 -1728 -1522 -985 -307 49 323 153 -825 560 430 -284 -294 83 149 1716 536 -1051 -567 -561 -1055 -513 -426 -757 -1612 -768 -271 680 809 298 1392 726 313 949 641 349 554 378 -302 -322 91 443 -110 711 330 1164 589 473 -163 211 301 -829 565 -960 435 134 -479 -841 154 122 -1065 -215 SS 20250721T154603.2Z 9333.656981 325 1 54.18 2 34.70 114.65 15.81 222.39 0.00 1 0.00 1 0 17 7.672e-03 6.230e-03 1.680e-03 1.130e-03 1.664239e-01 5.908318e-04 2.025178e-03 -6.000000e+00 4.486953e-03 232.49 -2.00 3.49 -2.00 315.02 0.00e+00 2.805676e-04 5.124941e-05 6.671988e-05 -6.000000e+00 1.995819e-04 289.22 -2.00 20.00 -2.00 314.34 0.00e+00 1.215 0.000 302.00 328.00 3 4.9564e+00 1.5289e-03 1.4796e-02 -6.0000e+00 1.1254e-02 2.4241e-02 1.6890e-03 8.6810e-03 -6.0000e+00 1.2141e-02 -3.1554e-03 9.6586e-04 4.2081e-03 -6.0000e+00 7.2312e-03 -3.0924e-03 4.2741e-04 1.1526e-03 -6.0000e+00 3.0794e-03 9.6513e-04 -3.5707e-04 3.1876e-05 1.5677e-05 -6.0000e+00 2.0852e-04 -1.2165e-02 0.0000e+00 10 0 0 10 0 0 99.99 25.91 0.26 -0.01216 -0.01485 76 9 1 5 0 712.800 34.25 20.00 25.91 34.67 1.7 1100.00 -616 -796 -1263 -2130 -1043 -1313 -720 1793 -65 562 -606 27 254 -3 1453 -478 -223 -155 576 468 21 1080 874 724 161 216 -514 -885 110 1226 1425 2142 918 -816 -1782 -730 -757 -646 -457 -442 -789 -1241 -1127 -359 -899 -604 -619 -839 -330 468 902 844 1079 1482 1270 1304 658 842 400 553 1314 1046 1488 774 164 -731 -412 260 797 646 319 -212 -25 114 123 -307 -288 -708 -811 -843 -857 -1381 -1321 -1803 -858 -406 -203 -174 115 241 244 50 15 600 368 28 43 -106 -81 -633 -910 -468 -433 -228 -758 -1003 -818 -17 196 791 1018 850 443 373 293 489 399 460 176 -76 -246 -32 -46 223 278 254 815 589 322 137 -3 -58 -112 283 -139 -45 -96 -105 -122 -147 -379 -315 -422 -202 -282 -454 -721 -308 -362 -204 553 -23 203 -217 10 96 -1 620 -224 -107 -76 287 240 11 554 451 388 84 116 -277 -487 55 579 683 1079 497 -460 -954 -370 -407 -371 -312 -325 -637 -981 -910 -289 -725 -483 -517 -675 -254 350 692 687 860 1226 1080 1125 580 740 347 474 1144 969 1385 767 163 -724 -367 217 686 624 320 -224 -26 119 121 -291 -262 -596 -685 -730 -830 -1385 -1414 -2027 -955 -484 -242 -216 144 292 293 58 15 622 391 30 48 -131 -101 -795 -1146 -540 -501 -267 -909 -1290 -1038 -23 265 1122 1428 1213 613 507 384 592 471 561 230 -102 -344 -46 -63 294 368 319 1021 720 386 175 -5 -76 -147 379 -197 -63 -141 -158 -186 -222 -558 -449 -616 SS 20250721T155501.6Z 9333.663212 331 1 9.31 2 33.15 117.21 16.99 227.81 0.00 1 0.00 1 0 17 9.968e-03 7.432e-03 4.389e-03 3.070e-03 1.616464e-01 1.603470e-03 1.998614e-03 -6.000000e+00 5.810477e-03 232.49 -2.00 3.49 -2.00 314.86 0.00e+00 4.641102e-04 1.350365e-04 8.304611e-05 -6.000000e+00 2.592715e-04 289.22 -2.00 20.00 -2.00 314.19 0.00e+00 1.194 0.000 302.00 328.00 3 4.9898e+00 4.1459e-03 1.4484e-02 -6.0000e+00 1.4571e-02 2.6555e-02 4.5817e-03 8.4729e-03 -6.0000e+00 1.5740e-02 -2.1351e-03 2.6160e-03 4.1086e-03 -6.0000e+00 9.3744e-03 -3.3764e-03 1.1520e-03 1.1188e-03 -6.0000e+00 3.9747e-03 9.6088e-04 -3.7810e-03 8.6558e-05 1.5900e-05 -6.0000e+00 2.7127e-04 1.3610e-02 0.0000e+00 12 9 1 12 33 1 -3704.07 25.93 -0.09 0.01361 -0.01480 3 3 1 5 0 2327.300 34.50 20.00 25.93 34.97 1.7 1100.00 -671 1176 -703 -2929 -2687 -2414 -1792 3002 496 749 -1788 881 -631 -50 1618 -2098 837 907 -75 227 218 2281 1379 1154 -81 64 -756 -6 712 565 -24 2574 1473 -529 -2013 -2239 -834 -440 -629 -897 -655 -757 -981 -1036 -1154 -328 -787 -756 260 -43 769 728 1193 1577 1285 1575 -80 643 648 687 1591 1563 1232 778 509 -427 -949 425 -87 598 458 -174 -197 555 418 158 -1056 -886 -839 -1049 -914 -1759 -1016 -1759 -1364 -579 -311 51 258 111 631 -151 217 1107 61 -205 323 20 -115 -427 -593 -984 -934 -692 -820 -978 -952 137 7 944 1323 1149 440 350 -60 406 239 384 496 593 -17 439 -403 576 -45 -78 736 120 -63 246 287 -35 -341 2 -169 92 -117 74 267 -258 -519 -208 -630 -229 425 -261 -1038 -914 -762 -580 1031 177 278 -666 316 -248 -22 714 -1035 412 453 -39 120 118 1192 729 634 -47 36 -421 -4 365 276 -12 1323 812 -304 -1104 -1177 -459 -259 -441 -683 -510 -615 -817 -871 -965 -270 -635 -625 204 -33 606 608 978 1341 1124 1392 -73 581 576 605 1420 1481 1186 794 520 -407 -871 363 -77 556 470 -179 -204 589 420 153 -922 -760 -721 -930 -904 -1812 -1110 -1910 -1567 -672 -383 65 331 138 734 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