File name: Pandora64s1_NewHavenCT_20230909_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20230910T045338.6Z 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 v1.8.49 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20230909_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: 20230909 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 20230909T132610.0Z 8652.559838 321 1 48.38 2 57.70 114.24 15.69 209.38 0.00 1 0.00 1 0 17 1.107e-02 7.584e-03 6.709e-04 3.071e-04 2.389878e-01 1.656650e-04 2.897398e-03 -6.000000e+00 6.745245e-03 229.75 -2.00 3.52 -2.00 316.41 0.00e+00 2.823555e-04 1.948418e-05 7.938887e-05 -6.000000e+00 3.020191e-04 288.14 -2.00 20.00 -2.00 315.63 0.00e+00 1.865 0.000 302.00 328.00 3 1.8069e+00 4.3181e-04 2.2458e-02 -6.0000e+00 1.6801e-02 -4.7837e-03 4.8074e-04 1.2457e-02 -6.0000e+00 1.8119e-02 2.1255e-03 2.7829e-04 6.0638e-03 -6.0000e+00 1.0811e-02 -4.5042e-03 1.2965e-04 1.6809e-03 -6.0000e+00 4.6041e-03 1.0277e-02 7.5645e-06 9.5248e-06 2.1768e-05 -6.0000e+00 3.2941e-04 -4.9024e-03 4.1240e-05 11 8 0 10 0 0 99.97 21.34 0.16 -0.00490 -0.00485 758 182 1 5 0 63.810 25.90 19.96 21.34 29.82 38.8 1044.91 886 -1120 373 -3383 -5016 -1891 -89 486 1220 -44 -3106 -1773 -67 -295 917 514 -759 796 339 1536 1000 -424 938 951 557 926 487 -977 -786 286 1809 198 2216 -80 -4454 -2109 -1623 -1049 184 72 -983 -1080 -284 -883 -476 -21 -733 -162 -639 -278 1175 717 692 1335 203 793 1079 573 103 470 538 1306 1202 2133 609 -1219 -198 -1349 738 1662 304 396 -228 479 173 -636 -651 -1815 -412 -277 -1152 -720 -1963 -1986 -482 -458 58 123 843 394 403 466 -634 68 955 412 -68 1081 592 -499 -391 -1445 -1631 201 376 -1392 -283 -779 -292 255 791 332 260 119 -99 -77 537 -239 532 375 -140 -301 637 -3 931 930 -731 634 977 386 549 -414 -618 -345 439 -117 -502 284 118 -471 24 -704 150 -203 67 -569 -860 -317 -16 87 237 -9 -639 -386 -16 -81 256 155 -237 257 113 525 346 -148 337 360 219 372 191 -363 -279 101 676 79 937 -34 -1865 -904 -721 -542 104 46 -632 -721 -193 -602 -324 -14 -482 -104 -433 -180 800 518 526 995 156 618 848 448 80 368 441 1144 1061 1939 539 -1072 -166 -1140 635 1575 293 391 -222 468 156 -553 -527 -1459 -354 -251 -1163 -750 -2174 -2210 -569 -546 72 155 1041 461 457 512 -657 71 1058 479 -83 1354 762 -654 -481 -1763 -1961 241 483 -1806 -384 -1056 -415 366 1165 483 375 168 -130 -102 689 -323 734 541 -205 -431 884 -4 1224 1223 -943 837 1309 549 777 -603 -926 -518 694 -185 -814 465 193 -750 39 -1106 SS 20230909T133605.9Z 8652.566735 324 1 48.07 2 56.02 116.40 16.69 216.25 0.00 1 0.00 1 0 17 2.497e-02 9.193e-03 4.735e-03 1.946e-03 2.329083e-01 1.047241e-03 2.818867e-03 -6.000000e+00 1.522278e-02 229.75 -2.00 3.52 -2.00 316.75 0.00e+00 5.861618e-04 1.330627e-04 1.024238e-04 -6.000000e+00 6.815117e-04 288.14 -2.00 20.00 -2.00 315.95 0.00e+00 1.783 0.000 302.00 328.00 3 5.2467e+00 2.7439e-03 2.1626e-02 -6.0000e+00 3.7918e-02 4.0652e-02 3.0599e-03 1.2162e-02 -6.0000e+00 4.0884e-02 -1.7680e-03 1.7877e-03 5.9219e-03 -6.0000e+00 2.4395e-02 -3.2656e-03 8.4480e-04 1.6754e-03 -6.0000e+00 1.0394e-02 3.5277e-04 2.8712e-04 6.0926e-05 2.0866e-05 -6.0000e+00 7.4281e-04 -5.2490e-03 1.4440e-04 11 8 0 10 0 0 99.95 21.32 0.08 -0.00525 -0.00309 52 13 1 5 0 924.200 25.90 20.01 21.32 30.97 38.5 1050.13 1729 -967 1594 -1795 -25124 -1352 643 -1568 4294 2293 -3361 -2100 -520 -162 2207 1058 -905 2373 169 2558 1895 1114 2527 1153 27 728 882 62 -681 -2335 2041 650 2602 1029 -4412 -1901 -1376 -930 212 -29 -1235 -863 -277 -1311 -436 -182 -423 -290 -739 -1249 1449 1276 373 1509 186 372 944 286 375 628 529 1369 1604 2166 1092 -1131 -438 -1659 885 1237 223 698 -185 310 -50 -898 -379 -2268 -1441 -288 -1190 -1109 -1926 -1972 -439 -299 210 365 1053 556 584 563 -1403 -388 869 661 177 1276 795 -621 -405 -1603 -2147 -133 278 -1733 -141 -338 -240 474 990 547 288 7 -428 -490 345 -313 561 430 157 -184 666 49 1066 729 -724 806 797 300 479 -609 -712 -307 441 56 -170 440 187 -508 -216 -897 265 -159 256 -270 -4368 -186 93 -257 721 403 -616 -406 -111 -39 546 283 -254 673 50 771 578 340 791 383 9 257 303 20 -211 -744 663 225 951 376 -1599 -702 -565 -444 112 -17 -791 -541 -177 -844 -278 -115 -274 -184 -463 -802 964 851 263 1102 140 285 726 219 283 479 423 1166 1378 1922 938 -962 -354 -1354 772 1136 219 699 -183 293 -43 -749 -292 -1744 -1188 -262 -1144 -1163 -2037 -2204 -520 -358 261 459 1302 652 662 586 -1456 -401 954 759 214 1656 1058 -806 -493 -1932 -2555 -166 353 -2327 -196 -470 -351 726 1492 814 425 9 -573 -632 451 -430 786 630 232 -268 937 68 1418 928 -944 1023 1077 428 681 -890 -1070 -482 697 92 -286 749 316 -840 -347 -1406 SS 20230909T134459.4Z 8652.572909 327 1 48.36 2 54.54 118.40 17.73 221.76 0.00 1 0.00 1 0 17 1.095e-02 7.724e-03 4.064e-04 2.204e-04 2.211908e-01 1.195695e-04 2.694739e-03 -6.000000e+00 6.670813e-03 229.75 -2.00 3.52 -2.00 315.89 0.00e+00 2.889293e-04 1.245638e-05 5.515589e-05 -6.000000e+00 2.987252e-04 288.14 -2.00 20.00 -2.00 315.13 0.00e+00 1.719 0.000 302.00 328.00 3 1.3814e+00 3.0974e-04 2.0726e-02 -6.0000e+00 1.6616e-02 -7.2220e-03 3.4362e-04 1.1521e-02 -6.0000e+00 1.7920e-02 1.8992e-03 1.9746e-04 5.6184e-03 -6.0000e+00 1.0693e-02 -3.8107e-03 8.9671e-05 1.5637e-03 -6.0000e+00 4.5525e-03 1.8728e-02 -3.2517e-04 6.8197e-06 2.1058e-05 -6.0000e+00 3.2589e-04 -4.3623e-03 -7.9565e-06 11 8 0 10 0 0 86.79 21.35 0.19 -0.00436 -0.00681 938 226 1 5 0 51.540 25.90 19.97 21.35 31.87 38.5 1055.55 643 -1063 91 -3285 -4850 -1836 -486 827 1142 220 -3186 -1466 162 67 1073 680 -709 856 406 1664 1143 -328 847 898 534 1128 572 -950 -557 284 1744 128 2282 -181 -4322 -2127 -1538 -959 280 66 -1030 -1120 -296 -930 -443 7 -747 -149 -752 -208 1207 832 716 1328 181 732 1058 569 140 449 607 1309 1165 2090 581 -1259 -226 -1394 716 1547 206 379 -247 556 185 -612 -646 -1769 -448 -246 -1166 -706 -1999 -2013 -506 -506 -1 74 797 417 370 487 -634 164 959 394 -92 1063 576 -480 -402 -1377 -1613 181 375 -1363 -293 -786 -336 256 697 265 187 135 -118 10 587 -191 544 363 -109 -271 608 42 966 1030 -645 672 962 417 564 -434 -616 -341 424 -111 -522 244 82 -517 2 -717 144 -253 21 -721 -991 -366 -103 192 287 57 -842 -406 46 21 377 255 -277 319 156 654 454 -131 349 388 240 516 256 -401 -223 114 730 57 1072 -86 -2003 -1009 -758 -550 176 44 -737 -831 -211 -704 -334 6 -543 -105 -525 -147 896 618 558 1077 151 620 855 483 118 382 512 1177 1060 1953 527 -1125 -192 -1191 657 1488 203 382 -246 552 170 -538 -556 -1507 -385 -236 -1181 -739 -2127 -2264 -578 -613 -2 90 958 497 425 537 -658 170 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