File name: Pandora21s1_Bremen_20200907_L2Fit_fout2c14d20191026p1-8.txt File generation date: 20250507T105438.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c14p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v14d20191026.txt Level 1 file used: Pandora21s1_Bremen_20200907_L1_smca1c14d20191026p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20200907 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.1120 305.2523 305.3926 305.5329 305.6731 305.8134 305.9537 306.0939 306.2341 306.3744 306.5146 306.6548 306.7950 306.9352 307.0753 307.2155 307.3557 307.4958 307.6359 307.7761 307.9162 308.0563 308.1964 308.3364 308.4765 308.6166 308.7566 308.8966 309.0367 309.1767 309.3167 309.4567 309.5967 309.7366 309.8766 310.0166 310.1565 310.2964 310.4363 310.5763 310.7162 310.8560 310.9959 311.1358 311.2756 311.4155 311.5553 311.6952 311.8350 311.9748 312.1146 312.2543 312.3941 312.5339 312.6736 312.8134 312.9531 313.0928 313.2325 313.3722 313.5119 313.6516 313.7913 313.9309 314.0706 314.2102 314.3498 314.4894 314.6290 314.7686 314.9082 315.0478 315.1873 315.3269 315.4664 315.6059 315.7455 315.8850 316.0245 316.1639 316.3034 316.4429 316.5823 316.7218 316.8612 317.0006 317.1400 317.2794 317.4188 317.5582 317.6976 317.8369 317.9763 318.1156 318.2549 318.3942 318.5335 318.6728 318.8121 318.9514 319.0906 319.2299 319.3691 319.5083 319.6475 319.7867 319.9259 320.0651 320.2043 320.3435 320.4826 320.6217 320.7609 320.9000 321.0391 321.1782 321.3173 321.4563 321.5954 321.7345 321.8735 322.0125 322.1515 322.2906 322.4296 322.5685 322.7075 322.8465 322.9854 323.1244 323.2633 323.4022 323.5411 323.6800 323.8189 323.9578 324.0967 324.2355 324.3744 324.5132 324.6520 324.7908 324.9296 --------------------------------------------------------------------------------------- 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 20200907T064710.2Z 7555.282757 270 1 4.42 2 72.73 103.64 62.37 250.43 0.00 1 0.00 1 0 25 5.395e-02 6.767e-03 3.336e-02 3.213e-03 4.382052e-01 1.678538e-03 5.705005e-03 -6.000000e+00 3.222333e-02 229.60 -2.00 3.88 -2.00 318.87 0.00e+00 4.325734e-04 3.450195e-04 1.869812e-04 -6.000000e+00 1.291010e-03 280.34 -2.00 20.00 -2.00 318.56 0.00e+00 3.319 0.001 302.00 328.00 3 2.7555e+00 4.5585e-03 4.1621e-02 -6.0000e+00 8.0944e-02 3.4221e-02 5.1557e-03 2.5210e-02 -6.0000e+00 8.7971e-02 -1.3268e-02 3.8962e-03 1.2616e-02 -6.0000e+00 5.1636e-02 3.8559e-04 2.0837e-03 3.6600e-03 -6.0000e+00 2.1271e-02 7.4019e-04 -6.6321e-04 9.8626e-05 4.3989e-05 -6.0000e+00 1.6233e-03 -1.9356e-03 0.0000e+00 12 9 1 12 1 1 76.64 22.32 0.25 -0.00194 -0.00692 11 28 1 5 0 354.180 25.28 20.00 22.32 19.85 19.9 995.10 35653 -17026 16114 -30979 7177 -4525 -6799 1416 -6295 11412 -15949 4049 -4172 11861 -6331 -1254 -5187 -5723 -147 -8281 962 -2842 3659 -9028 1290 -2054 -1664 -3811 2759 5509 1360 3112 -1955 1160 -3625 2378 -1905 -421 1456 -1250 365 -3434 1340 -2054 1642 -1712 1136 -843 -146 1288 272 2181 -323 1645 -429 1608 -223 64 -62 499 1412 603 2494 551 162 34 522 1109 1423 -78 -200 -49 -471 908 -722 -222 -413 788 -77 445 -99 -1778 -1033 -1366 -1103 -776 -444 -269 -307 -224 1049 739 663 1185 927 1355 910 -250 -676 -484 -639 -177 563 -348 -698 -994 -822 -437 360 -161 -74 -40 231 27 592 890 194 642 -343 -621 -820 -297 -35 -181 312 446 1571 1128 547 -153 3 339 419 39 -394 -4 -39 199 -438 -187 -293 -61 -174 698 -581 419 -1170 183 -129 -215 47 -244 400 -746 175 -226 657 -480 -101 -469 -555 -14 -901 99 -306 389 -1150 159 -271 -218 -495 332 673 190 479 -342 203 -648 409 -374 -95 380 -380 119 -1217 471 -754 589 -636 414 -313 -55 497 113 956 -153 810 -223 844 -120 34 -33 265 767 352 1539 365 109 22 332 708 964 -58 -159 -40 -385 712 -542 -155 -273 512 -53 337 -83 -1621 -988 -1365 -1150 -842 -498 -308 -350 -250 1111 746 643 1147 944 1484 1080 -320 -905 -647 -825 -216 660 -413 -866 -1282 -1094 -601 513 -242 -116 -65 367 41 874 1273 277 938 -523 -975 -1302 -465 -53 -273 457 635 2173 1577 803 -237 5 564 713 69 -716 -8 -74 383 -845 -356 -545 -111 -310 SS 20200907T070547.0Z 7555.295682 276 1 7.92 2 70.04 107.62 64.93 254.50 0.00 1 0.00 1 0 25 1.807e-02 5.386e-03 8.009e-03 1.235e-03 3.842162e-01 6.453555e-04 5.036453e-03 -6.000000e+00 1.079443e-02 229.60 -2.00 3.88 -2.00 318.36 0.00e+00 1.218995e-03 1.141863e-04 1.371656e-04 -6.000000e+00 4.324386e-04 280.34 -2.00 20.00 -2.00 318.04 0.00e+00 2.898 0.000 302.00 328.00 3 1.9860e+00 1.7334e-03 3.6373e-02 -6.0000e+00 2.7115e-02 2.7997e-02 1.9448e-03 2.2033e-02 -6.0000e+00 2.9469e-02 -1.0230e-02 1.3409e-03 1.0956e-02 -6.0000e+00 1.7297e-02 8.7592e-04 7.0463e-04 3.1456e-03 -6.0000e+00 7.1259e-03 2.5554e-03 -5.7822e-04 3.8096e-05 3.7371e-05 -6.0000e+00 5.4374e-04 -2.4035e-03 0.0000e+00 12 1 1 12 1 1 99.46 22.32 0.19 -0.00240 -0.00675 63 81 1 5 0 120.928 25.28 20.00 22.32 21.62 19.8 1002.79 -1189 -5288 -8491 935 -9141 -409 -7688 3261 -5480 -4270 -5265 -3105 -1732 -2837 -15 -2617 2042 -2148 713 -34 -374 -366 458 804 -1513 -912 -3086 -947 -1079 1309 1488 2198 486 -1318 -1169 -1501 138 663 886 -850 -190 -1091 -613 -518 -475 -575 -1738 -517 -320 1165 824 1109 479 534 896 798 764 58 745 788 1761 1394 1403 402 -176 72 -232 932 756 599 -259 -110 -678 -536 -267 -66 381 446 365 -230 -252 -1547 -1475 -1014 -943 -528 -626 -135 -252 177 334 460 919 1181 817 767 647 -42 -503 -419 -224 -87 617 -107 -828 -587 -546 -285 -51 51 -195 -107 -98 163 385 726 610 256 -152 -722 -666 -349 -284 62 424 533 1222 1014 408 350 88 242 112 163 -103 -95 74 -46 -460 -217 -87 -243 -126 -52 -262 -440 42 -419 -18 -376 161 -323 -261 -337 -213 -137 -270 -2 -302 242 -282 96 -5 -54 -53 69 128 -261 -162 -554 -160 -178 217 271 444 109 -306 -263 -344 34 182 290 -308 -75 -460 -266 -228 -210 -256 -781 -229 -143 531 404 554 258 305 530 487 449 34 454 480 1045 898 989 291 -129 50 -163 650 543 482 -219 -97 -594 -449 -217 -48 271 310 271 -185 -219 -1442 -1482 -1029 -1020 -582 -727 -161 -299 202 371 470 916 1163 861 863 784 -54 -672 -557 -292 -109 724 -129 -1022 -768 -722 -396 -73 75 -307 -167 -156 244 557 1029 859 361 -229 -1110 -1042 -537 -424 92 600 748 1639 1373 595 533 138 382 183 278 -179 -169 135 -86 -867 -400 -155 -426 -216 SS 20200907T071940.0Z 7555.305324 286 1 7.91 2 68.07 110.66 66.87 257.45 0.00 1 0.00 1 0 25 1.919e-02 5.905e-03 1.109e-02 2.309e-03 3.516730e-01 1.204643e-03 4.630903e-03 -6.000000e+00 1.146542e-02 229.60 -2.00 3.88 -2.00 317.95 0.00e+00 4.630325e-04 1.900766e-04 1.091135e-04 -6.000000e+00 4.593279e-04 280.34 -2.00 20.00 -2.00 317.64 0.00e+00 2.654 0.000 302.00 328.00 3 3.3965e+00 3.2122e-03 3.3289e-02 -6.0000e+00 2.8801e-02 3.8410e-02 3.5914e-03 2.0125e-02 -6.0000e+00 3.1301e-02 -6.4254e-03 2.3377e-03 9.9632e-03 -6.0000e+00 1.8372e-02 -9.1493e-04 1.2011e-03 2.8375e-03 -6.0000e+00 7.5688e-03 8.1938e-04 -4.6743e-04 7.1411e-05 3.4091e-05 -6.0000e+00 5.7755e-04 -2.3236e-03 0.0000e+00 12 1 1 12 1 1 99.57 22.32 0.23 -0.00232 -0.00584 15 22 1 5 0 455.445 25.28 20.00 22.32 22.02 19.8 1003.74 1932 -5332 -10159 -7865 -10265 -3273 -5405 -965 -1570 -4306 -3523 -1185 2113 -2105 1355 -1118 1255 -1263 1227 -2234 -669 -70 3679 728 166 -1755 -3198 -1801 -976 1595 204 2588 -1209 -2674 -2147 -444 -236 464 502 -366 22 -1508 -433 -664 -557 -539 228 355 -493 1251 1274 1174 1023 739 691 429 658 813 223 1161 1287 1437 1504 251 117 124 -115 674 667 512 123 158 -457 -712 -178 -106 229 225 483 -457 -1057 -1542 -1395 -1429 -1177 -742 -253 -550 -288 -335 26 282 1066 1446 928 837 727 160 -387 -453 -202 -105 344 -71 -575 -929 -520 -277 34 -83 -298 173 -190 231 282 932 570 456 -167 -294 -628 -54 -156 120 312 394 1271 1038 578 379 -121 132 233 196 -279 -267 76 -197 -573 -136 -165 -172 -52 117 -354 -713 -541 -672 -199 -364 -70 -126 -370 -309 -110 206 -251 180 -168 197 -214 213 -416 -125 -13 689 141 34 -380 -694 -368 -203 330 44 600 -314 -717 -555 -114 -67 154 188 -159 10 -726 -213 -331 -278 -269 112 173 -243 624 678 641 597 457 444 271 421 517 147 760 832 1000 1139 195 91 92 -85 494 503 432 108 146 -421 -629 -152 -82 169 162 369 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