File name: Pandora64s1_NewHavenCT_20240817_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240818T050152.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240817_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240817 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20240817T162031.9Z 8995.680925 337 1 48.36 2 29.22 162.31 158.17 50.81 0.00 1 0.00 1 0 17 1.050e-02 7.973e-03 6.255e-04 4.373e-04 1.589171e-01 2.406532e-04 1.938499e-03 -6.000000e+00 6.440251e-03 231.61 -2.00 3.52 -2.00 314.84 0.00e+00 3.274057e-04 2.031039e-05 3.249665e-05 -6.000000e+00 2.884959e-04 289.83 -2.00 20.00 -2.00 314.16 0.00e+00 1.145 0.000 302.00 328.00 3 3.3145e+00 6.1959e-04 1.4233e-02 -6.0000e+00 1.6105e-02 2.5378e-02 6.8266e-04 8.3242e-03 -6.0000e+00 1.7341e-02 1.5808e-03 3.9048e-04 4.0362e-03 -6.0000e+00 1.0341e-02 -4.8806e-03 1.7037e-04 1.1178e-03 -6.0000e+00 4.3933e-03 5.2817e-03 1.8438e-04 1.3463e-05 1.6162e-05 -6.0000e+00 3.1265e-04 -2.5456e-03 5.5836e-05 11 8 0 10 0 0 99.99 21.37 0.20 -0.00255 -0.00116 383 92 1 5 0 126.230 25.90 19.95 21.37 31.40 40.7 1053.17 831 -678 269 -2830 -4240 -730 -216 1336 1556 420 -2795 -1199 155 42 1115 487 -765 972 410 1586 1162 -347 925 809 440 956 569 -1079 -297 393 1873 -64 2430 -582 -4151 -2043 -1488 -1075 389 -165 -1072 -1212 -338 -1140 -338 -145 -631 -273 -639 -396 1238 320 856 1205 289 790 1092 539 213 435 664 1267 1211 2021 512 -1296 -257 -1436 759 1457 291 420 -145 679 127 -706 -756 -1889 -560 -283 -1228 -632 -2027 -1948 -493 -452 45 161 775 401 291 459 -776 68 817 378 -96 1196 520 -392 -482 -1378 -1622 276 216 -1308 -288 -653 -224 391 769 332 237 79 -168 -76 517 -205 542 365 -41 -166 628 -107 894 885 -711 623 899 289 487 -508 -562 -350 508 -104 -422 256 117 -479 31 -770 293 -249 97 -939 -1299 -216 -68 455 569 158 -1048 -464 65 18 519 239 -384 495 214 843 620 -186 506 460 240 527 327 -582 -150 196 957 -34 1354 -325 -2246 -1130 -913 -709 277 -132 -854 -997 -281 -949 -278 -117 -527 -219 -501 -312 1011 276 717 1045 256 706 980 481 189 390 620 1181 1191 2022 492 -1225 -228 -1273 720 1429 305 451 -154 685 125 -635 -668 -1636 -513 -268 -1210 -671 -2154 -2185 -588 -540 56 202 957 494 330 503 -793 69 874 417 -116 1458 648 -472 -579 -1566 -1828 327 260 -1658 -380 -850 -304 549 1102 465 313 101 -211 -92 634 -252 710 504 -54 -229 838 -136 1134 1069 -838 745 1130 362 628 -670 -758 -492 712 -152 -631 369 177 -708 45 -1087 SS 20240817T162458.5Z 8995.684010 340 1 48.38 2 28.98 164.48 157.55 52.69 0.00 1 0.00 1 0 25 1.031e-02 8.125e-03 1.623e-04 1.209e-04 1.581840e-01 6.676852e-05 1.939261e-03 -6.000000e+00 6.322080e-03 231.61 -2.00 3.52 -2.00 314.52 0.00e+00 3.287321e-04 5.306865e-06 1.855527e-05 -6.000000e+00 2.832425e-04 289.83 -2.00 20.00 -2.00 313.88 0.00e+00 1.143 0.000 302.00 328.00 3 8.8725e-01 1.7138e-04 1.4196e-02 -6.0000e+00 1.5810e-02 7.3002e-03 1.8847e-04 8.3041e-03 -6.0000e+00 1.7024e-02 9.3862e-04 1.0809e-04 4.0294e-03 -6.0000e+00 1.0153e-02 -3.9704e-03 4.6905e-05 1.1186e-03 -6.0000e+00 4.3116e-03 6.0473e-02 -1.9043e-04 3.7063e-06 1.6673e-05 -6.0000e+00 3.0702e-04 -1.9914e-03 -9.1390e-06 11 8 0 10 0 0 78.99 21.37 0.24 -0.00199 -0.00342 2040 491 1 5 0 23.700 25.90 20.03 21.37 31.69 40.6 1055.60 1082 -842 378 -2897 -3519 -1137 46 1254 1432 216 -2875 -1235 265 8 1143 551 -749 903 409 1648 1068 -288 885 879 425 1101 524 -876 -394 556 1822 157 2304 -206 -4177 -1927 -1468 -977 199 -84 -1195 -1191 -447 -1031 -467 -68 -748 -147 -660 -152 1216 949 779 1321 157 788 1029 575 206 505 644 1306 1043 1962 395 -1314 -262 -1454 752 1479 181 333 -237 607 181 -587 -706 -1833 -430 -251 -1165 -772 -2088 -1938 -494 -486 -30 17 732 354 380 449 -649 197 988 393 -24 1080 547 -466 -368 -1288 -1488 255 318 -1352 -255 -755 -286 259 703 276 216 126 -81 57 623 -198 549 380 -35 -226 621 20 1001 1046 -537 730 964 390 550 -473 -590 -348 430 -158 -518 235 37 -543 -17 -754 414 -337 148 -1126 -1254 -395 17 501 571 88 -1175 -521 121 4 585 297 -414 507 220 904 589 -160 500 517 258 675 312 -488 -220 305 1028 93 1332 -119 -2497 -1104 -933 -676 151 -67 -1025 -1001 -381 -877 -393 -56 -631 -119 -522 -121 1004 822 669 1172 143 722 947 526 187 464 588 1266 1019 1950 395 -1216 -239 -1326 700 1511 189 356 -251 609 176 -543 -635 -1617 -381 -245 -1198 -819 -2244 -2197 -570 -595 -37 21 890 424 437 492 -663 209 1056 439 -28 1299 672 -577 -430 -1487 -1704 295 393 -1695 -333 -986 -389 351 972 373 287 160 -100 67 747 -251 715 500 -47 -298 823 26 1246 1239 -647 856 1189 485 707 -620 -792 -469 587 -224 -754 334 53 -782 -24 -1036 SS 20240817T163004.1Z 8995.687547 343 1 48.37 2 28.75 167.00 156.81 54.75 0.00 1 0.00 1 0 25 1.034e-02 8.161e-03 1.613e-04 1.201e-04 1.580384e-01 6.627371e-05 1.931390e-03 -6.000000e+00 6.341830e-03 231.61 -2.00 3.52 -2.00 314.52 0.00e+00 3.270073e-04 5.275191e-06 1.789971e-05 -6.000000e+00 2.841165e-04 289.83 -2.00 20.00 -2.00 313.88 0.00e+00 1.140 0.000 302.00 328.00 3 8.7126e-01 1.7021e-04 1.4162e-02 -6.0000e+00 1.5859e-02 7.7150e-03 1.8724e-04 8.2795e-03 -6.0000e+00 1.7077e-02 1.1891e-03 1.0725e-04 4.0155e-03 -6.0000e+00 1.0184e-02 -4.1253e-03 4.6461e-05 1.1150e-03 -6.0000e+00 4.3255e-03 6.1604e-02 -1.2278e-04 3.6775e-06 1.6688e-05 -6.0000e+00 3.0795e-04 -2.3121e-03 7.2288e-06 11 8 0 10 0 0 92.54 21.37 0.25 -0.00231 -0.00323 2118 510 1 5 0 22.820 25.90 20.02 21.37 32.47 40.6 1060.53 1037 -833 393 -2880 -3525 -1099 -50 1228 1421 237 -2900 -1267 298 30 1148 538 -740 878 439 1684 1098 -263 870 860 451 1114 522 -865 -381 536 1841 138 2327 -198 -4215 -1972 -1494 -1029 176 -92 -1155 -1201 -421 -1015 -430 -40 -719 -149 -635 -155 1201 978 746 1328 205 793 1057 600 218 507 613 1315 1088 1946 420 -1289 -269 -1469 734 1485 192 349 -214 592 197 -571 -691 -1824 -446 -287 -1191 -749 -2090 -1973 -520 -511 -16 15 738 373 379 461 -634 184 950 400 -44 1107 542 -457 -362 -1307 -1475 230 294 -1350 -291 -777 -294 243 698 296 223 140 -75 56 622 -204 535 394 -47 -203 634 8 1007 1028 -545 724 960 391 544 -441 -598 -334 425 -165 -530 221 16 -522 -23 -783 394 -331 153 -1113 -1249 -380 -18 488 563 96 -1178 -531 135 14 584 289 -406 490 251 918 602 -145 489 502 272 679 309 -511 -211 292 1032 82 1336 -113 -2505 -1197 -943 -708 133 -73 -985 -1002 -356 -857 -359 -35 -602 -120 -499 -122 985 842 636 1170 184 722 967 545 197 462 584 1265 1105 1921 417 -1244 -244 -1331 711 1505 199 370 -224 591 190 -525 -617 -1596 -413 -279 -1216 -788 -2331 -2220 -596 -620 -19 18 890 443 432 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