File name: Pandora206s1_BuffaloNY_20241226_L2Fit_fout2c6d20240814p1-8.txt File generation date: 20241227T051943.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v6d20240814.txt Level 1 file used: Pandora206s1_BuffaloNY_20241226_L1_smca1c6d20240814p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: United States Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20241226 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: None First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0348 305.1758 305.3167 305.4577 305.5987 305.7396 305.8805 306.0215 306.1624 306.3033 306.4442 306.5850 306.7259 306.8668 307.0076 307.1484 307.2893 307.4301 307.5709 307.7117 307.8524 307.9932 308.1340 308.2747 308.4154 308.5561 308.6968 308.8375 308.9782 309.1189 309.2596 309.4002 309.5408 309.6815 309.8221 309.9627 310.1033 310.2438 310.3844 310.5250 310.6655 310.8060 310.9466 311.0871 311.2276 311.3681 311.5085 311.6490 311.7894 311.9299 312.0703 312.2107 312.3511 312.4915 312.6319 312.7723 312.9126 313.0530 313.1933 313.3336 313.4740 313.6143 313.7545 313.8948 314.0351 314.1753 314.3156 314.4558 314.5960 314.7362 314.8764 315.0166 315.1568 315.2970 315.4371 315.5772 315.7174 315.8575 315.9976 316.1377 316.2777 316.4178 316.5579 316.6979 316.8379 316.9780 317.1180 317.2580 317.3980 317.5379 317.6779 317.8178 317.9578 318.0977 318.2376 318.3775 318.5174 318.6573 318.7972 318.9370 319.0769 319.2167 319.3565 319.4963 319.6361 319.7759 319.9157 320.0554 320.1952 320.3349 320.4747 320.6144 320.7541 320.8938 321.0335 321.1731 321.3128 321.4524 321.5921 321.7317 321.8713 322.0109 322.1505 322.2900 322.4296 322.5692 322.7087 322.8482 322.9877 323.1272 323.2667 323.4062 323.5457 323.6851 323.8246 323.9640 324.1034 324.2428 324.3822 324.5216 324.6610 324.8003 324.9397 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20241226T143200.3Z 9126.605559 203 1 45.75 2 76.31 141.68 64.63 193.84 0.00 1 0.00 1 0 17 1.912e-01 6.150e-03 1.329e-01 3.448e-03 4.634161e-01 1.729516e-03 5.388382e-03 -6.000000e+00 1.052212e-01 222.76 -2.00 3.55 -2.00 320.39 0.00e+00 1.944903e-03 6.047471e-04 4.853908e-04 -6.000000e+00 4.554657e-03 273.61 -2.00 20.00 -2.00 319.88 0.00e+00 4.128 0.001 302.00 328.00 3 2.5805e+00 5.1182e-03 4.6661e-02 -6.0000e+00 2.5943e-01 5.4135e-03 6.3212e-03 2.4608e-02 -6.0000e+00 2.8334e-01 -4.5189e-03 5.9617e-03 1.2518e-02 -6.0000e+00 1.6852e-01 -5.7116e-03 3.0704e-03 4.3993e-03 -6.0000e+00 7.2057e-02 4.4111e-04 -6.2425e-04 9.9840e-05 4.3072e-05 -6.0000e+00 4.8651e-03 5.8315e-03 0.0000e+00 10 0 0 10 0 0 99.97 17.58 0.37 0.00583 0.00114 196 61 2 8 0 233.400 14.99 17.58 7.19 21.27 21.06 23.4 934.05 -48121 27541 -35579 -5742 -71643 77387 -16587 -35546 -67398 156405 -13169 -23811 -10106 1102 687 -27572 28201 -13040 6979 -7310 12476 -6913 -482 -8042 -2249 -2495 -2860 4243 -14320 6364 -4866 6274 -9634 3038 -771 -5782 -9133 578 -52 1108 -6170 5818 -513 -1678 2034 -1842 1829 -2703 4797 -22 2578 716 1566 2505 1150 982 1174 -674 701 767 -181 993 451 3690 720 -1127 1019 -1416 642 188 1101 31 771 422 931 247 921 -1761 92 -1697 -617 -664 -2218 -1310 -1122 -882 -451 1219 158 1175 178 1869 -376 44 316 137 176 981 136 -68 -208 -848 -430 -311 -420 -1350 -612 -517 -284 -135 91 84 267 179 -155 236 -156 674 -767 804 -504 56 41 311 -101 380 128 720 708 133 359 25 -85 -58 -110 -425 -4 356 35 -180 -11 -231 -160 -660 207 -543 -64 -1371 347 -189 -552 -1639 526 -208 -443 -199 24 18 -1073 744 -563 265 -338 490 -327 -22 -433 -122 -144 -171 227 -874 324 -317 419 -798 241 -65 -492 -822 55 -6 155 -1049 933 -92 -313 368 -354 341 -531 892 -5 552 173 405 694 341 300 370 -217 217 233 -57 337 173 1522 319 -481 408 -581 276 94 608 18 448 235 477 114 386 -739 41 -896 -371 -454 -1679 -1030 -945 -797 -427 1174 155 1103 156 1491 -288 33 258 127 186 1175 167 -83 -256 -956 -441 -322 -477 -1635 -772 -693 -381 -198 144 140 437 279 -225 344 -229 1024 -1180 1289 -825 89 63 494 -154 553 178 1012 1103 214 623 46 -162 -114 -234 -957 -10 833 82 -412 -24 -480 -322 SS 20241226T143734.0Z 9126.609422 206 1 26.85 2 75.69 142.83 64.90 195.23 0.00 1 0.00 1 0 25 2.046e-01 8.310e-03 1.757e-01 6.234e-03 4.495574e-01 3.102788e-03 5.270544e-03 -6.000000e+00 1.125662e-01 222.76 -2.00 3.55 -2.00 320.11 0.00e+00 -5.094275e-04 9.871912e-04 4.613165e-04 -6.000000e+00 4.872453e-03 273.61 -2.00 20.00 -2.00 319.59 0.00e+00 3.960 0.001 302.00 328.00 3 3.6892e+00 8.9284e-03 4.4756e-02 -6.0000e+00 2.7754e-01 3.1634e-02 1.0832e-02 2.3318e-02 -6.0000e+00 3.0311e-01 -1.0243e-02 9.8352e-03 1.2016e-02 -6.0000e+00 1.8028e-01 -5.9977e-03 5.1511e-03 3.6630e-03 -6.0000e+00 7.7091e-02 1.7146e-04 -5.5425e-04 1.7935e-04 3.8525e-05 -6.0000e+00 5.2044e-03 5.4769e-03 0.0000e+00 11 8 0 10 0 0 98.96 17.58 0.53 0.00548 0.00131 27 27 2 8 0 994.090 15.00 17.58 7.54 21.27 21.06 23.5 936.67 13879 -35691 150572 -12755 44644 -34973 6196 -13545 -29043 52549 -30311 20589 -31401 36834 -4376 140509 -14932 21834 -7773 4240 7592 -969 2618 -17772 5829 1164 5658 -14192 5320 -11017 3813 -6177 5217 -5212 5898 -8495 -3579 -921 404 2309 -1030 -137 2854 3906 -485 567 -6778 -3952 -111 1297 1226 1360 -2401 1362 3752 509 4054 -549 2339 -9752 2875 256 1932 3057 -764 615 -1245 -750 -62 1273 1884 1724 -64 3553 -491 387 -1377 925 -2050 -158 -1030 -235 -2479 -1213 -1116 -1208 1001 -364 864 186 924 238 2040 -355 -786 -644 222 1125 -14 162 -195 -55 -699 802 -954 -676 -1530 269 -443 174 30 80 -68 58 209 -107 451 -474 356 46 -45 -210 542 -618 -394 214 371 1303 182 1336 694 274 -582 58 -748 -266 -59 13 217 340 -123 -653 151 134 -651 915 -194 339 -567 72 -220 -633 559 -753 323 -986 709 -153 1476 -741 808 -414 211 377 -52 141 -1288 360 80 384 -1122 323 -798 269 -545 465 -560 535 -857 -379 -111 59 401 -209 -29 619 855 -111 130 -1673 -949 -26 309 318 389 -710 419 1191 172 1371 -195 850 -3621 1043 103 789 1369 -369 276 -544 -326 -29 670 1097 1055 -40 2042 -272 206 -680 433 -1058 -93 -650 -166 -1957 -991 -977 -1139 971 -370 874 183 834 200 1573 -277 -668 -619 240 1367 -19 214 -243 -63 -729 835 -1108 -827 -1977 362 -644 254 47 133 -111 91 301 -156 655 -725 537 73 -72 -331 826 -987 -597 311 512 1807 282 2088 1177 490 -1082 112 -1561 -584 -133 29 499 752 -261 -1327 296 SS 20241226T151823.7Z 9126.637774 228 1 46.60 2 71.64 151.64 67.53 205.06 0.00 1 0.00 1 0 25 3.132e-02 4.933e-03 3.078e-03 3.796e-04 3.642008e-01 1.853521e-04 4.369890e-03 -6.000000e+00 1.723443e-02 222.76 -2.00 3.55 -2.00 318.99 0.00e+00 8.379863e-04 4.209441e-05 1.366815e-04 -6.000000e+00 7.459465e-04 273.61 -2.00 20.00 -2.00 318.43 0.00e+00 3.136 0.001 302.00 328.00 3 9.3663e-02 5.0459e-04 3.5617e-02 -6.0000e+00 4.2493e-02 -8.1900e-03 5.8127e-04 1.8701e-02 -6.0000e+00 4.6406e-02 -1.6095e-02 4.2857e-04 9.4002e-03 -6.0000e+00 2.7601e-02 2.9164e-04 2.2829e-04 2.8677e-03 -6.0000e+00 1.1804e-02 1.5290e-02 -3.1891e-04 1.0659e-05 2.9663e-05 -6.0000e+00 7.9673e-04 4.7498e-03 0.0000e+00 10 0 0 10 0 0 83.69 17.60 0.30 0.00475 0.00235 1427 441 2 8 0 32.070 14.99 17.60 7.77 21.27 21.06 23.2 935.90 -10711 -8922 -6719 -9476 -12611 -13366 -11737 -9271 -8792 -7360 -9628 -8809 -5969 -4246 -2037 -1653 -1209 -311 -7 486 637 -165 245 -380 -608 28 -814 -1598 -2516 -1008 458 703 1495 -431 -2661 -2691 -2535 -1707 -820 -131 -621 -449 -464 -411 146 -80 -200 -92 -314 48 1089 890 1167 1265 947 1046 866 579 540 433 938 1190 1619 1984 544 117 -247 -550 350 492 486 529 277 594 210 -181 -378 -1091 -473 -780 -943 -865 -1878 -1586 -1155 -711 -238 -126 441 388 545 412 212 429 455 127 376 755 224 -136 -190 -544 -561 -9 -678 -820 -762 -654 -348 77 191 128 85 75 -6 220 237 276 74 37 -297 -35 197 150 551 339 464 1032 593 314 203 -8 -204 -16 -98 -79 -111 176 -102 -169 -106 -297 -290 -381 -355 -277 -388 -468 -474 -437 -378 -405 -363 -485 -454 -348 -290 -161 -150 -117 -32 -1 54 73 -19 28 -48 -81 4 -118 -221 -327 -129 64 108 255 -80 -474 -459 -474 -367 -212 -40 -195 -148 -160 -145 51 -28 -70 -32 -110 17 408 365 510 591 465 525 448 300 273 216 479 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