File name: Pandora64s1_NewHavenCT_20240723_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240724T050435.9Z 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_20240723_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: 20240723 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 20240723T181351.5Z 8970.759623 501 1 15.32 2 26.81 222.56 150.06 333.54 0.00 1 0.00 1 0 17 1.296e-02 8.706e-03 3.185e-03 2.214e-03 1.735268e-01 1.218823e-03 2.103632e-03 -6.000000e+00 7.968158e-03 232.63 -2.00 3.52 -2.00 314.87 0.00e+00 4.912194e-04 1.034680e-04 4.296989e-05 -6.000000e+00 3.555462e-04 289.53 -2.00 20.00 -2.00 314.20 0.00e+00 1.120 0.000 302.00 328.00 3 5.2779e+00 3.1474e-03 1.4567e-02 -6.0000e+00 1.9979e-02 3.6993e-02 3.4709e-03 9.0989e-03 -6.0000e+00 2.1508e-02 -3.5119e-04 1.9835e-03 4.3970e-03 -6.0000e+00 1.2813e-02 -3.1008e-03 8.6304e-04 1.2175e-03 -6.0000e+00 5.4190e-03 7.3005e-04 2.5800e-04 6.7886e-05 1.7340e-05 -6.0000e+00 3.8602e-04 7.6503e-03 1.2932e-05 12 9 1 12 1 1 99.69 21.70 0.21 0.00765 0.00959 6 5 1 5 0 2186.360 26.11 20.01 21.70 31.60 40.4 1059.77 -38 -1008 872 -3441 -8997 -415 362 87 2160 -367 -2183 -745 1239 -329 1479 520 -471 1441 664 1835 2257 -292 1678 1117 941 819 367 -1358 -723 -229 1781 -215 2512 -889 -3448 -1810 -1674 -966 411 -524 -1011 -1673 -427 -1149 -220 211 -268 -539 -1375 -433 1106 1210 654 1109 518 957 973 128 372 910 377 1801 1073 2123 450 -1268 -275 -1103 593 1486 320 596 -424 545 -12 -679 -232 -1844 -1081 -231 -1107 -1189 -2124 -1162 -455 -384 -192 -79 685 27 446 492 -1102 20 1134 67 18 908 408 -676 -22 -1646 -1573 489 244 -1283 -609 -411 143 573 1130 268 -37 184 -248 -269 475 -48 663 460 139 22 868 -106 1111 618 -1019 1148 726 75 503 -582 -392 -530 502 -368 -126 282 127 -517 106 -1107 -13 -359 300 -1101 -2794 -126 117 29 766 -134 -793 -284 511 -145 702 248 -230 712 338 951 1159 -153 892 620 538 453 205 -715 -377 -119 904 -116 1396 -492 -1845 -1004 -989 -630 297 -407 -828 -1422 -365 -982 -186 174 -214 -420 -1097 -347 885 1012 574 963 457 855 875 115 329 812 355 1717 1046 2093 440 -1200 -246 -989 554 1515 335 635 -446 543 -12 -610 -200 -1582 -995 -224 -1140 -1277 -2317 -1329 -537 -463 -241 -100 848 32 511 534 -1127 21 1221 76 22 1129 514 -823 -26 -1916 -1821 576 296 -1645 -788 -550 193 805 1561 375 -50 238 -309 -324 581 -60 856 622 190 29 1123 -135 1387 736 -1234 1359 911 96 659 -780 -520 -736 709 -524 -182 415 185 -738 151 -1558 SS 20240723T183143.7Z 8970.772033 507 1 48.35 2 29.23 229.87 151.21 341.65 0.00 1 0.00 1 0 17 9.919e-03 7.628e-03 3.963e-04 2.671e-04 1.723290e-01 1.465939e-04 2.082454e-03 -6.000000e+00 6.097127e-03 232.63 -2.00 3.52 -2.00 315.04 0.00e+00 2.592855e-04 1.283447e-05 3.006075e-05 -6.000000e+00 2.720779e-04 289.53 -2.00 20.00 -2.00 314.35 0.00e+00 1.145 0.000 302.00 328.00 3 2.3297e+00 3.7917e-04 1.4715e-02 -6.0000e+00 1.5287e-02 1.4794e-02 4.1828e-04 9.0268e-03 -6.0000e+00 1.6458e-02 2.8466e-03 2.3878e-04 4.3711e-03 -6.0000e+00 9.8045e-03 -4.6110e-03 1.0437e-04 1.1994e-03 -6.0000e+00 4.1463e-03 1.3741e-02 3.3129e-04 8.2003e-06 1.6865e-05 -6.0000e+00 2.9540e-04 7.9336e-03 5.5504e-06 11 8 0 10 0 0 99.95 21.70 0.18 0.00793 0.01042 901 217 1 5 0 53.650 26.11 20.01 21.70 32.69 40.3 1065.37 827 -993 178 -3237 -3256 -764 385 1284 1431 126 -2700 -776 240 -58 1097 233 -749 877 311 1724 818 -238 899 819 317 1045 199 -898 -296 762 1671 153 2287 -858 -3943 -1591 -1336 -749 241 -134 -1265 -1093 -441 -1075 -366 -128 -750 -129 -745 -20 1253 653 820 1253 124 876 1035 617 323 563 687 1317 1086 1894 56 -1201 -258 -1325 1082 1315 125 275 -261 588 51 -594 -661 -1727 -206 -413 -1174 -772 -2133 -1726 -405 -468 14 15 782 238 495 365 -585 350 980 247 -43 1084 344 -516 -410 -1322 -1348 445 97 -1276 -154 -757 -167 277 696 202 191 48 -72 172 611 -206 523 287 -138 -204 607 -116 1143 790 -568 763 818 325 460 -507 -567 -211 448 -222 -402 284 -9 -454 31 -788 274 -344 60 -1004 -930 -215 115 420 501 45 -968 -290 91 -24 499 112 -367 438 148 836 398 -117 452 429 172 570 105 -442 -148 378 859 77 1197 -446 -2148 -830 -779 -473 176 -103 -1032 -917 -353 -911 -308 -106 -599 -100 -563 -15 996 547 673 1062 107 766 910 537 280 495 632 1287 1058 1871 53 -1113 -226 -1169 1028 1296 131 294 -275 588 50 -526 -576 -1488 -189 -396 -1172 -831 -2301 -1965 -466 -569 17 19 975 280 562 401 -601 359 1070 280 -50 1362 439 -635 -499 -1527 -1552 541 120 -1662 -199 -1017 -233 385 983 279 259 63 -87 214 736 -263 680 391 -190 -276 792 -151 1410 977 -688 946 1015 423 618 -662 -761 -295 629 -324 -601 429 -14 -666 44 -1104 SS 20240723T183713.4Z 8970.775849 511 1 48.97 2 30.03 231.92 151.47 344.24 0.00 1 0.00 1 0 17 9.947e-03 7.738e-03 1.530e-04 1.085e-04 1.734249e-01 5.985232e-05 2.107709e-03 -6.000000e+00 6.113533e-03 232.63 -2.00 3.52 -2.00 314.79 0.00e+00 2.543471e-04 4.993397e-06 2.323723e-05 -6.000000e+00 2.728769e-04 289.53 -2.00 20.00 -2.00 314.12 0.00e+00 1.155 0.000 302.00 328.00 3 6.2015e-01 1.5440e-04 1.4833e-02 -6.0000e+00 1.5328e-02 -4.5911e-04 1.7004e-04 9.1016e-03 -6.0000e+00 1.6503e-02 2.7707e-03 9.7250e-05 4.4082e-03 -6.0000e+00 9.8313e-03 -3.9230e-03 4.2217e-05 1.2097e-03 -6.0000e+00 4.1567e-03 7.5510e-02 5.9846e-05 3.3244e-06 1.7784e-05 -6.0000e+00 2.9628e-04 8.2141e-03 -4.1473e-05 11 8 0 10 0 0 94.63 21.71 0.24 0.00821 0.00866 2519 606 1 5 0 19.190 26.11 19.98 21.71 33.13 40.7 1068.57 595 -1038 61 -3301 -3195 -920 134 1162 1406 -55 -2808 -843 241 40 1126 309 -703 897 404 1742 871 -158 987 812 359 1109 261 -821 -306 781 1751 133 2353 -801 -3966 -1544 -1322 -794 247 -188 -1273 -1135 -442 -1155 -385 -218 -746 -109 -650 -11 1278 822 819 1207 133 892 1003 545 327 586 734 1280 1037 1835 38 -1182 -191 -1319 1046 1286 63 198 -332 560 73 -507 -570 -1583 -118 -336 -1127 -744 -2157 -1774 -505 -556 -88 -74 646 210 460 425 -519 459 1053 327 -50 1047 307 -510 -345 -1234 -1271 505 146 -1280 -214 -807 -230 207 583 143 180 100 -13 208 676 -182 563 289 -135 -201 626 -19 1197 905 -441 869 914 372 507 -481 -570 -261 410 -283 -482 216 -62 -483 41 -791 206 -375 22 -1149 -1023 -290 45 427 514 -21 -1052 -330 103 18 542 157 -365 475 206 904 454 -83 531 455 208 648 147 -434 -163 413 958 72 1325 -448 -2162 -867 -831 -546 186 -150 -1025 -941 -371 -968 -320 -177 -621 -88 -511 -9 1060 681 708 1079 115 784 886 477 285 518 679 1201 1029 1847 36 -1104 -168 -1174 1003 1295 64 208 -342 573 72 -454 -496 -1362 -108 -326 -1152 -785 -2409 -2006 -583 -679 -107 -92 779 248 520 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