File name: Pandora64s1_NewHavenCT_20250331_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20250401T050504.8Z 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 v1.8.75 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20250331_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: 20250331 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 20250331T185333.6Z 9221.787194 351 1 25.60 2 45.29 223.66 21.90 178.29 0.00 1 0.00 1 0 17 1.303e-02 8.346e-03 2.431e-03 1.368e-03 2.064499e-01 7.355945e-04 2.518725e-03 -6.000000e+00 7.869601e-03 227.39 -2.00 3.52 -2.00 315.72 0.00e+00 3.226901e-04 7.219128e-05 5.742232e-05 -6.000000e+00 3.415863e-04 278.52 -2.00 20.00 -2.00 315.13 0.00e+00 1.420 0.000 302.00 328.00 3 4.5605e+00 1.8948e-03 1.7763e-02 -6.0000e+00 1.9557e-02 3.8291e-02 2.1031e-03 1.0577e-02 -6.0000e+00 2.1162e-02 -4.4494e-04 1.2102e-03 5.2116e-03 -6.0000e+00 1.2577e-02 -4.1409e-03 5.4736e-04 1.4767e-03 -6.0000e+00 5.3328e-03 1.0503e-03 2.2596e-04 4.2346e-05 2.0142e-05 -6.0000e+00 3.8736e-04 -4.8883e-03 7.0673e-05 12 9 1 12 1 1 99.99 21.52 0.02 -0.00489 -0.00319 39 18 1 5 0 639.780 25.90 20.01 21.52 20.59 39.8 1015.32 1405 -562 656 -2323 -8720 -239 -100 1902 419 1070 -3823 -663 -666 418 1091 793 -1265 1451 -312 1842 1307 216 898 1449 37 1635 -54 -276 -1034 -26 1128 377 2493 -321 -4780 -1973 -1589 -903 155 181 -1012 -1316 -472 -1086 -470 32 -583 7 -722 -752 1252 1023 903 1089 142 566 1284 490 370 427 552 878 1582 1826 1142 -1628 -105 -1479 861 1613 322 523 -147 423 106 -725 -521 -2280 -559 -387 -941 -871 -2046 -2035 -338 -534 361 88 987 362 304 141 -1022 -233 968 405 -108 1017 670 -300 -370 -1375 -1891 206 416 -1378 -283 -534 -282 276 943 420 213 130 -268 -120 286 -229 514 601 -93 103 465 174 825 1045 -1098 586 841 475 353 -454 -867 -315 466 1 -426 277 159 -473 -51 -693 328 -139 159 -524 -2042 -52 -23 447 108 280 -1028 -183 -205 142 386 299 -496 576 -129 771 551 91 391 656 17 779 -25 -120 -432 -11 488 172 1191 -154 -2254 -945 -799 -526 100 124 -744 -1003 -365 -841 -361 24 -429 5 -507 -537 929 800 739 884 118 477 1084 412 307 359 485 786 1491 1775 1065 -1498 -91 -1288 802 1580 324 537 -149 426 99 -641 -446 -1942 -480 -369 -947 -912 -2272 -2286 -402 -646 451 112 1230 428 345 153 -1044 -248 1041 459 -129 1302 876 -380 -442 -1614 -2196 250 518 -1814 -373 -734 -390 400 1394 612 294 173 -344 -148 359 -302 696 849 -129 145 635 235 1057 1327 -1370 744 1083 643 478 -629 -1236 -450 701 2 -657 432 247 -718 -78 -1033 SS 20250331T185805.2Z 9221.790338 354 1 48.41 2 45.89 225.00 21.88 181.08 0.00 1 0.00 1 0 17 1.088e-02 8.032e-03 2.766e-04 1.693e-04 2.077123e-01 9.145317e-05 2.540435e-03 -6.000000e+00 6.566633e-03 227.39 -2.00 3.52 -2.00 315.44 0.00e+00 3.658719e-04 8.485424e-06 3.433380e-05 -6.000000e+00 2.850416e-04 278.52 -2.00 20.00 -2.00 314.89 0.00e+00 1.434 0.000 302.00 328.00 3 1.1679e+00 2.3486e-04 1.7925e-02 -6.0000e+00 1.6319e-02 1.4020e-02 2.6038e-04 1.0654e-02 -6.0000e+00 1.7659e-02 -2.6729e-03 1.4939e-04 5.2420e-03 -6.0000e+00 1.0495e-02 -2.9507e-03 6.6617e-05 1.4883e-03 -6.0000e+00 4.4495e-03 3.1045e-02 4.2264e-06 5.2404e-06 2.0596e-05 -6.0000e+00 3.2331e-04 -4.9203e-03 2.4277e-05 11 8 0 10 0 0 99.87 21.53 0.23 -0.00492 -0.00489 1469 354 1 5 0 32.790 25.90 20.01 21.53 20.94 39.8 1017.83 816 -985 263 -3095 -4202 -1599 -415 875 1214 51 -3256 -1585 -37 -82 989 654 -654 944 501 1789 1162 -264 952 922 467 1154 541 -948 -700 289 1703 142 2333 -34 -4346 -2152 -1636 -1048 226 70 -1088 -1133 -381 -960 -433 47 -702 -114 -655 -207 1191 924 737 1367 261 858 1166 665 210 477 571 1253 1136 2083 527 -1379 -337 -1546 659 1579 239 373 -174 606 222 -644 -777 -1956 -550 -321 -1177 -752 -2058 -2028 -529 -505 23 88 794 421 385 435 -682 51 903 341 -58 1126 638 -408 -372 -1395 -1568 230 422 -1299 -260 -789 -315 274 721 311 208 91 -178 -63 591 -167 610 469 -23 -188 651 20 953 968 -723 595 966 401 508 -470 -684 -363 440 -108 -526 282 108 -471 -5 -769 228 -268 76 -836 -1049 -390 -107 247 370 15 -957 -487 -12 -31 382 269 -278 411 225 818 536 -122 453 459 225 564 258 -457 -320 131 805 71 1146 -17 -2246 -1061 -897 -624 147 51 -809 -872 -298 -751 -336 36 -525 -83 -494 -158 898 735 614 1120 219 731 999 566 177 407 509 1131 1088 2046 501 -1289 -298 -1375 597 1573 243 388 -178 591 210 -583 -652 -1712 -485 -299 -1156 -801 -2224 -2314 -613 -619 28 109 965 505 445 461 -712 53 997 395 -70 1408 817 -507 -454 -1607 -1862 274 516 -1677 -335 -1065 -427 389 1049 445 282 119 -226 -80 730 -218 814 655 -33 -262 877 26 1209 1221 -893 750 1234 541 682 -647 -967 -515 657 -161 -808 438 167 -709 -7 -1143 SS 20250331T190201.2Z 9221.793069 357 1 14.77 2 46.41 226.15 21.90 183.50 0.00 1 0.00 1 0 17 1.089e-02 8.005e-03 1.131e-03 6.971e-04 2.103548e-01 3.762245e-04 2.570871e-03 -6.000000e+00 6.574612e-03 227.39 -2.00 3.52 -2.00 315.38 0.00e+00 3.547657e-04 3.456324e-05 3.206147e-05 -6.000000e+00 2.853850e-04 278.52 -2.00 20.00 -2.00 314.83 0.00e+00 1.448 0.000 302.00 328.00 3 2.7831e+00 9.6589e-04 1.8112e-02 -6.0000e+00 1.6338e-02 2.7457e-02 1.0710e-03 1.0779e-02 -6.0000e+00 1.7680e-02 -3.1676e-03 6.1407e-04 5.3087e-03 -6.0000e+00 1.0508e-02 -2.3702e-03 2.7403e-04 1.5078e-03 -6.0000e+00 4.4549e-03 6.0247e-03 -3.1810e-05 2.1426e-05 2.0940e-05 -6.0000e+00 3.2369e-04 -4.9511e-03 3.0334e-05 12 9 1 12 1 1 99.80 21.54 0.19 -0.00495 -0.00519 73 58 1 5 0 199.540 26.00 20.00 21.54 21.28 39.9 1018.90 705 -1137 -136 -2931 -4413 -1871 -368 1127 1214 75 -3144 -1975 25 -535 1011 693 -724 910 496 1759 1141 -192 897 869 730 1090 729 -652 -504 286 2073 57 2535 -197 -3955 -1991 -1505 -1080 263 77 -1011 -1199 -317 -1063 -368 12 -616 -176 -737 -174 1195 1101 700 1342 190 871 1119 479 190 448 447 1226 1144 2014 440 -1326 -482 -1439 751 1544 152 475 -254 528 193 -588 -717 -1935 -469 -283 -1146 -719 -2058 -2012 -581 -475 -93 71 843 443 351 463 -753 103 927 292 -157 1151 630 -405 -421 -1301 -1597 205 579 -1394 -297 -727 -340 198 808 233 145 76 -110 47 655 -206 658 378 12 -183 682 99 944 1033 -649 637 936 391 475 -517 -692 -350 483 -213 -530 254 135 -438 6 -867 186 -316 -37 -808 -1128 -467 -97 324 349 22 -944 -623 9 -208 400 292 -316 406 228 824 539 -91 408 414 360 546 356 -321 -235 133 1001 27 1274 -100 -1949 -1005 -844 -660 176 55 -770 -946 -254 -854 -293 9 -471 -131 -539 -128 923 897 567 1128 164 760 984 418 164 392 388 1132 1069 1930 429 -1206 -437 -1310 696 1500 158 483 -268 527 186 -544 -615 -1641 -423 -269 -1151 -748 -2275 -2245 -689 -570 -116 90 1045 521 397 501 -803 110 998 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