File name: Pandora75s1_EssexMD_20250403_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250404T051551.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20250403_L1_smca1c3d20230525p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20250403 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 session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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 20250403T172001.6Z 9224.722241 265 1 51.87 2 33.80 184.91 58.85 77.31 0.00 1 0.00 1 0 17 9.561e-03 7.805e-03 2.146e-04 1.609e-04 1.629129e-01 8.581789e-05 1.936670e-03 -6.000000e+00 5.722292e-03 227.85 -2.00 3.48 -2.00 314.47 0.00e+00 6.284015e-04 6.707229e-06 3.649450e-05 -6.000000e+00 2.511338e-04 280.20 -2.00 20.00 -2.00 313.95 0.00e+00 1.203 0.000 302.00 328.00 3 1.5083e+00 2.1879e-04 1.4563e-02 -6.0000e+00 1.4213e-02 1.8051e-02 2.4282e-04 8.2012e-03 -6.0000e+00 1.5429e-02 -5.2265e-03 1.3904e-04 3.9861e-03 -6.0000e+00 9.1858e-03 -4.1511e-03 5.8800e-05 1.1403e-03 -6.0000e+00 3.8097e-03 3.0383e-02 2.0796e-04 5.0441e-06 1.7154e-05 -6.0000e+00 2.9590e-04 5.8184e-03 7.3985e-05 11 8 0 10 0 0 99.99 23.79 0.48 0.00582 0.00738 1243 202 1 5 0 41.490 26.51 20.00 23.79 27.52 5.9 1023.43 572 278 -685 -1837 -2407 -1646 -716 240 221 -1255 -2065 -1717 -887 -268 503 129 176 822 1338 1382 1352 1369 1548 1401 1215 1014 117 -454 -76 283 614 1187 529 -1361 -2810 -2827 -2378 -1304 -217 -495 -796 -421 -398 -258 -128 18 -258 -487 -460 13 472 840 1031 1025 737 862 711 307 259 611 1118 1595 1803 1318 486 -272 -615 -242 554 1093 662 723 646 462 49 -723 -1302 -1641 -1723 -1576 -1787 -1961 -1988 -1686 -797 -415 250 577 485 447 330 -106 -443 -216 -133 101 469 543 143 -271 -847 -1245 -769 -438 -789 -900 -507 -280 403 760 799 578 379 56 -72 -55 137 432 501 437 468 590 583 621 649 302 253 325 309 109 -202 -377 -240 9 72 102 357 236 66 3 -449 -895 -1026 214 113 -284 -729 -935 -595 -262 94 88 -530 -877 -731 -400 -124 255 67 94 445 739 781 774 782 890 833 706 605 70 -274 -42 152 334 673 316 -840 -1688 -1666 -1401 -868 -159 -374 -659 -346 -335 -219 -108 15 -221 -402 -367 10 380 708 866 896 663 785 655 283 236 555 1040 1495 1721 1315 481 -263 -579 -219 518 1070 677 740 664 480 48 -675 -1161 -1456 -1564 -1488 -1784 -2046 -2117 -1886 -905 -482 304 693 584 538 384 -118 -471 -220 -140 110 538 651 180 -335 -998 -1434 -887 -500 -930 -1124 -636 -365 525 1035 1084 783 510 73 -89 -66 166 523 647 578 614 798 769 785 807 372 300 385 383 137 -264 -486 -315 12 99 142 510 344 97 4 -631 -1275 -1448 SS 20250403T172907.9Z 9224.728564 268 1 51.59 2 34.01 188.96 57.19 78.46 0.00 1 0.00 1 0 17 9.615e-03 7.804e-03 2.250e-04 1.669e-04 1.632806e-01 8.911377e-05 1.944325e-03 -6.000000e+00 5.754535e-03 227.85 -2.00 3.48 -2.00 314.52 0.00e+00 6.294343e-04 7.010631e-06 3.914109e-05 -6.000000e+00 2.525532e-04 280.20 -2.00 20.00 -2.00 313.99 0.00e+00 1.206 0.000 302.00 328.00 3 1.5718e+00 2.2746e-04 1.4602e-02 -6.0000e+00 1.4293e-02 1.6678e-02 2.5245e-04 8.2256e-03 -6.0000e+00 1.5516e-02 -5.4098e-03 1.4440e-04 4.0022e-03 -6.0000e+00 9.2376e-03 -4.0325e-03 6.1193e-05 1.1457e-03 -6.0000e+00 3.8311e-03 2.8426e-02 1.9870e-04 5.2378e-06 1.7146e-05 -6.0000e+00 2.9758e-04 5.9007e-03 7.1153e-05 11 8 0 10 0 0 99.99 23.80 0.49 0.00590 0.00739 1225 199 1 5 0 42.110 26.51 19.99 23.80 28.78 6.0 1034.20 636 238 -612 -1881 -2386 -1632 -781 180 237 -1251 -2120 -1661 -984 -200 407 203 211 789 1366 1403 1380 1389 1646 1438 1268 963 125 -527 -72 299 590 1155 443 -1400 -2850 -2815 -2390 -1308 -283 -555 -782 -424 -370 -235 -81 5 -266 -522 -493 7 430 827 1015 1028 744 849 702 313 239 622 1098 1579 1829 1324 480 -272 -606 -228 582 1151 682 762 724 488 39 -695 -1298 -1603 -1698 -1550 -1810 -1938 -2008 -1669 -828 -417 233 593 516 428 364 -84 -441 -212 -128 94 439 523 142 -267 -875 -1272 -776 -434 -819 -909 -517 -299 402 755 815 602 407 48 -105 -85 102 409 501 443 450 549 572 641 644 300 212 301 293 85 -188 -399 -211 27 106 133 371 245 66 -13 -467 -897 -1042 233 94 -247 -729 -905 -576 -279 69 92 -516 -880 -690 -433 -90 202 109 110 418 737 774 773 776 925 836 765 562 77 -312 -40 168 335 641 259 -846 -1676 -1623 -1464 -852 -202 -433 -634 -358 -320 -205 -70 5 -222 -422 -406 6 340 683 878 880 655 758 634 283 214 553 1001 1451 1788 1295 487 -258 -558 -202 535 1104 683 797 761 497 39 -666 -1192 -1394 -1512 -1435 -1773 -1983 -2189 -1831 -923 -494 278 726 633 506 415 -92 -460 -222 -133 105 514 640 175 -325 -1054 -1499 -880 -506 -986 -1115 -662 -383 534 1010 1125 830 557 61 -133 -101 121 505 636 575 601 730 742 826 818 364 257 365 357 110 -241 -526 -283 36 148 189 540 351 95 -18 -669 -1256 -1447 SS 20250403T173551.1Z 9224.733230 272 1 51.59 2 34.24 191.91 55.95 79.31 0.00 1 0.00 1 0 17 9.643e-03 7.830e-03 1.926e-04 1.441e-04 1.636023e-01 7.690862e-05 1.949299e-03 -6.000000e+00 5.770834e-03 227.85 -2.00 3.48 -2.00 314.48 0.00e+00 6.039311e-04 5.999177e-06 3.772359e-05 -6.000000e+00 2.532688e-04 280.20 -2.00 20.00 -2.00 313.96 0.00e+00 1.209 0.000 302.00 328.00 3 1.2857e+00 1.9620e-04 1.4640e-02 -6.0000e+00 1.4334e-02 1.3737e-02 2.1764e-04 8.2477e-03 -6.0000e+00 1.5560e-02 -5.0152e-03 1.2453e-04 4.0127e-03 -6.0000e+00 9.2638e-03 -3.9767e-03 5.2664e-05 1.1421e-03 -6.0000e+00 3.8419e-03 3.7730e-02 1.7679e-04 4.5305e-06 1.7359e-05 -6.0000e+00 2.9842e-04 5.8940e-03 7.0550e-05 11 8 0 10 0 0 99.95 23.80 0.49 0.00589 0.00722 1444 235 1 5 0 35.720 26.41 20.00 23.80 29.86 5.9 1040.63 603 278 -771 -1786 -2445 -1719 -764 206 206 -1227 -2011 -1663 -829 -228 497 231 260 805 1401 1409 1433 1306 1614 1410 1280 1040 154 -440 -83 360 643 1166 507 -1330 -2798 -2880 -2379 -1416 -294 -603 -816 -465 -367 -266 -128 18 -302 -476 -511 44 430 826 1006 1021 765 898 747 331 255 617 1127 1604 1838 1315 492 -267 -586 -226 568 1125 675 713 699 491 48 -734 -1351 -1641 -1694 -1584 -1799 -1959 -2002 -1703 -826 -463 202 584 482 457 370 -45 -424 -193 -116 100 467 529 119 -278 -870 -1253 -754 -450 -800 -887 -489 -288 398 768 754 550 341 22 -108 -44 134 434 514 429 456 549 585 626 683 311 266 354 310 102 -196 -412 -223 47 105 152 363 242 68 -34 -463 -916 -1044 230 115 -325 -720 -897 -633 -284 77 83 -527 -870 -721 -355 -107 241 121 141 445 788 764 788 717 891 806 759 634 94 -256 -48 198 358 675 291 -790 -1618 -1737 -1434 -912 -208 -467 -658 -391 -316 -231 -111 15 -252 -383 -418 35 355 681 867 875 674 801 673 298 228 549 1027 1477 1801 1292 480 -254 -540 -201 522 1083 680 750 738 503 48 -705 -1240 -1427 -1507 -1469 -1768 -2016 -2107 -1883 -929 -555 244 723 598 546 426 -50 -445 -202 -121 108 531 630 148 -342 -1058 -1433 -862 -529 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