mirror of https://github.com/abinit/abinit.git
471 lines
25 KiB
Plaintext
471 lines
25 KiB
Plaintext
#
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# Phonon density of states and atom projected DOS
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#
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# Energy in Ha , DOS in states/Ha
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# Gaussian method with smearing = 3.67493254E-05Ha , nqibz =145
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#
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# omega PHDOS PJDOS[atom=1] PJDOS[atom=2] ...
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#
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-1.80082949E-04 1.61471430E+02 1.61471430E+02
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-1.76408017E-04 1.73728055E+02 1.73728055E+02
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-1.72733084E-04 1.85886587E+02 1.85886587E+02
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-1.69058151E-04 1.97862082E+02 1.97862082E+02
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-1.65383219E-04 2.09577208E+02 2.09577208E+02
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-1.61708286E-04 2.20962553E+02 2.20962553E+02
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-1.58033354E-04 2.31956200E+02 2.31956200E+02
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-1.54358421E-04 2.42502687E+02 2.42502687E+02
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-1.50683489E-04 2.52551527E+02 2.52551527E+02
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-1.47008556E-04 2.62055489E+02 2.62055489E+02
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-1.43333624E-04 2.70968900E+02 2.70968900E+02
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-1.39658691E-04 2.79246184E+02 2.79246184E+02
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-1.35983759E-04 2.86840854E+02 2.86840854E+02
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-1.32308826E-04 2.93705112E+02 2.93705112E+02
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-1.28633894E-04 2.99790138E+02 2.99790138E+02
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-1.24958961E-04 3.05047079E+02 3.05047079E+02
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-1.21284028E-04 3.09428665E+02 3.09428665E+02
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-1.17609096E-04 3.12891307E+02 3.12891307E+02
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-1.13934163E-04 3.15397473E+02 3.15397473E+02
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-1.10259231E-04 3.16918110E+02 3.16918110E+02
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-1.06584298E-04 3.17434863E+02 3.17434863E+02
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-1.02909366E-04 3.16941860E+02 3.16941860E+02
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-9.92344332E-05 3.15446877E+02 3.15446877E+02
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-9.55595007E-05 3.12971746E+02 3.12971746E+02
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-9.18845681E-05 3.09551969E+02 3.09551969E+02
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-8.82096356E-05 3.05235540E+02 3.05235540E+02
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-8.45347030E-05 3.00081101E+02 3.00081101E+02
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-8.08597705E-05 2.94155580E+02 2.94155580E+02
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-7.71848380E-05 2.87531544E+02 2.87531544E+02
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-7.35099054E-05 2.80284491E+02 2.80284491E+02
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-6.98349729E-05 2.72490341E+02 2.72490341E+02
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-6.61600403E-05 2.64223327E+02 2.64223327E+02
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-6.24851078E-05 2.55554457E+02 2.55554457E+02
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-5.88101753E-05 2.46550667E+02 2.46550667E+02
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-5.51352427E-05 2.37274673E+02 2.37274673E+02
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-5.14603102E-05 2.27785489E+02 2.27785489E+02
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-4.77853776E-05 2.18139498E+02 2.18139498E+02
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-4.41104451E-05 2.08391889E+02 2.08391889E+02
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-4.04355126E-05 1.98598257E+02 1.98598257E+02
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-3.67605800E-05 1.88816147E+02 1.88816147E+02
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-3.30856475E-05 1.79106303E+02 1.79106303E+02
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-2.94107149E-05 1.69533472E+02 1.69533472E+02
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-2.57357824E-05 1.60166599E+02 1.60166599E+02
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-2.20608499E-05 1.51078371E+02 1.51078371E+02
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-1.83859173E-05 1.42344111E+02 1.42344111E+02
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-1.47109848E-05 1.34040088E+02 1.34040088E+02
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-1.10360522E-05 1.26241396E+02 1.26241396E+02
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-7.36111970E-06 1.19019575E+02 1.19019575E+02
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-3.68618716E-06 1.12440173E+02 1.12440173E+02
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-1.12546154E-08 1.06560484E+02 1.06560484E+02
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3.66367792E-06 1.01427628E+02 1.01427628E+02
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7.33861046E-06 9.70771461E+01 9.70771461E+01
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1.10135430E-05 9.35322158E+01 9.35322158E+01
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1.46884755E-05 9.08035253E+01 9.08035253E+01
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1.83634081E-05 8.88898074E+01 8.88898074E+01
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2.20383406E-05 8.77789606E+01 8.77789606E+01
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2.57132732E-05 8.74496538E+01 8.74496538E+01
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2.93882057E-05 8.78732774E+01 8.78732774E+01
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3.30631382E-05 8.90160938E+01 8.90160938E+01
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3.67380708E-05 9.08414445E+01 9.08414445E+01
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4.04130033E-05 9.33118872E+01 9.33118872E+01
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4.40879359E-05 9.63911653E+01 9.63911653E+01
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4.77628684E-05 1.00045940E+02 1.00045940E+02
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5.14378009E-05 1.04247248E+02 1.04247248E+02
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5.51127335E-05 1.08971663E+02 1.08971663E+02
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5.87876660E-05 1.14202165E+02 1.14202165E+02
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6.24625986E-05 1.19928708E+02 1.19928708E+02
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6.61375311E-05 1.26148478E+02 1.26148478E+02
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6.98124636E-05 1.32865815E+02 1.32865815E+02
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7.34873962E-05 1.40091746E+02 1.40091746E+02
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7.71623287E-05 1.47843084E+02 1.47843084E+02
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8.08372613E-05 1.56141005E+02 1.56141005E+02
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8.45121938E-05 1.65009077E+02 1.65009077E+02
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8.81871263E-05 1.74470685E+02 1.74470685E+02
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9.18620589E-05 1.84545893E+02 1.84545893E+02
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9.55369914E-05 1.95247824E+02 1.95247824E+02
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9.92119240E-05 2.06578706E+02 2.06578706E+02
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1.02886856E-04 2.18525815E+02 2.18525815E+02
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1.06561789E-04 2.31057615E+02 2.31057615E+02
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1.10236722E-04 2.44120420E+02 2.44120420E+02
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1.13911654E-04 2.57635936E+02 2.57635936E+02
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1.17586587E-04 2.71500017E+02 2.71500017E+02
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1.21261519E-04 2.85582907E+02 2.85582907E+02
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1.24936452E-04 2.99731163E+02 2.99731163E+02
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1.28611384E-04 3.13771322E+02 3.13771322E+02
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1.32286317E-04 3.27515251E+02 3.27515251E+02
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1.35961249E-04 3.40766971E+02 3.40766971E+02
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1.39636182E-04 3.53330635E+02 3.53330635E+02
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1.43311114E-04 3.65019204E+02 3.65019204E+02
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1.46986047E-04 3.75663329E+02 3.75663329E+02
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1.50660980E-04 3.85119892E+02 3.85119892E+02
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1.54335912E-04 3.93279681E+02 3.93279681E+02
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1.58010845E-04 4.00073733E+02 4.00073733E+02
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1.61685777E-04 4.05477955E+02 4.05477955E+02
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1.65360710E-04 4.09515760E+02 4.09515760E+02
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1.69035642E-04 4.12258577E+02 4.12258577E+02
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1.72710575E-04 4.13824219E+02 4.13824219E+02
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1.76385507E-04 4.14373210E+02 4.14373210E+02
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1.80060440E-04 4.14103297E+02 4.14103297E+02
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1.83735372E-04 4.13242424E+02 4.13242424E+02
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1.87410305E-04 4.12040537E+02 4.12040537E+02
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1.91085237E-04 4.10760596E+02 4.10760596E+02
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1.94760170E-04 4.09669205E+02 4.09669205E+02
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1.98435103E-04 4.09027272E+02 4.09027272E+02
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2.02110035E-04 4.09081079E+02 4.09081079E+02
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2.05784968E-04 4.10054123E+02 4.10054123E+02
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2.09459900E-04 4.12140065E+02 4.12140065E+02
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2.13134833E-04 4.15497052E+02 4.15497052E+02
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2.16809765E-04 4.20243623E+02 4.20243623E+02
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2.20484698E-04 4.26456376E+02 4.26456376E+02
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2.24159630E-04 4.34169439E+02 4.34169439E+02
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2.27834563E-04 4.43375752E+02 4.43375752E+02
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2.31509495E-04 4.54030057E+02 4.54030057E+02
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2.35184428E-04 4.66053416E+02 4.66053416E+02
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2.38859360E-04 4.79338997E+02 4.79338997E+02
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2.42534293E-04 4.93758804E+02 4.93758804E+02
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2.46209226E-04 5.09170993E+02 5.09170993E+02
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2.49884158E-04 5.25427395E+02 5.25427395E+02
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2.53559091E-04 5.42380877E+02 5.42380877E+02
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2.57234023E-04 5.59892193E+02 5.59892193E+02
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2.60908956E-04 5.77836057E+02 5.77836057E+02
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2.64583888E-04 5.96106210E+02 5.96106210E+02
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2.68258821E-04 6.14619334E+02 6.14619334E+02
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2.71933753E-04 6.33317748E+02 6.33317748E+02
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2.75608686E-04 6.52170877E+02 6.52170877E+02
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2.79283618E-04 6.71175523E+02 6.71175523E+02
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2.82958551E-04 6.90355041E+02 6.90355041E+02
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2.86633483E-04 7.09757505E+02 7.09757505E+02
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2.90308416E-04 7.29453021E+02 7.29453021E+02
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2.93983349E-04 7.49530298E+02 7.49530298E+02
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2.97658281E-04 7.70092691E+02 7.70092691E+02
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3.01333214E-04 7.91253869E+02 7.91253869E+02
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3.05008146E-04 8.13133383E+02 8.13133383E+02
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3.08683079E-04 8.35852399E+02 8.35852399E+02
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3.12358011E-04 8.59529928E+02 8.59529928E+02
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3.16032944E-04 8.84279916E+02 8.84279916E+02
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3.19707876E-04 9.10209577E+02 9.10209577E+02
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3.23382809E-04 9.37419320E+02 9.37419320E+02
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3.27057741E-04 9.66004565E+02 9.66004565E+02
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3.30732674E-04 9.96059640E+02 9.96059640E+02
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3.34407607E-04 1.02768376E+03 1.02768376E+03
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3.38082539E-04 1.06098895E+03 1.06098895E+03
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3.41757472E-04 1.09610945E+03 1.09610945E+03
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3.45432404E-04 1.13321205E+03 1.13321205E+03
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3.49107337E-04 1.17250644E+03 1.17250644E+03
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3.52782269E-04 1.21425462E+03 1.21425462E+03
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3.56457202E-04 1.25877830E+03 1.25877830E+03
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3.60132134E-04 1.30646314E+03 1.30646314E+03
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3.63807067E-04 1.35775889E+03 1.35775889E+03
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3.67481999E-04 1.41317465E+03 1.41317465E+03
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3.71156932E-04 1.47326870E+03 1.47326870E+03
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3.74831864E-04 1.53863287E+03 1.53863287E+03
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3.78506797E-04 1.60987156E+03 1.60987156E+03
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3.82181730E-04 1.68757629E+03 1.68757629E+03
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3.85856662E-04 1.77229668E+03 1.77229668E+03
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3.89531595E-04 1.86450935E+03 1.86450935E+03
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3.93206527E-04 1.96458642E+03 1.96458642E+03
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3.96881460E-04 2.07276515E+03 2.07276515E+03
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4.00556392E-04 2.18912085E+03 2.18912085E+03
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4.04231325E-04 2.31354437E+03 2.31354437E+03
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4.07906257E-04 2.44572584E+03 2.44572584E+03
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4.11581190E-04 2.58514565E+03 2.58514565E+03
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4.15256122E-04 2.73107344E+03 2.73107344E+03
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4.18931055E-04 2.88257538E+03 2.88257538E+03
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4.22605987E-04 3.03852960E+03 3.03852960E+03
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4.26280920E-04 3.19764906E+03 3.19764906E+03
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4.29955853E-04 3.35851108E+03 3.35851108E+03
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4.33630785E-04 3.51959201E+03 3.51959201E+03
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4.37305718E-04 3.67930560E+03 3.67930560E+03
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4.40980650E-04 3.83604331E+03 3.83604331E+03
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4.44655583E-04 3.98821491E+03 3.98821491E+03
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4.48330515E-04 4.13428739E+03 4.13428739E+03
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4.52005448E-04 4.27282085E+03 4.27282085E+03
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4.55680380E-04 4.40249984E+03 4.40249984E+03
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4.59355313E-04 4.52215906E+03 4.52215906E+03
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4.63030245E-04 4.63080257E+03 4.63080257E+03
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4.66705178E-04 4.72761620E+03 4.72761620E+03
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4.70380110E-04 4.81197289E+03 4.81197289E+03
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4.74055043E-04 4.88343148E+03 4.88343148E+03
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4.77729976E-04 4.94172933E+03 4.94172933E+03
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4.81404908E-04 4.98676984E+03 4.98676984E+03
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4.85079841E-04 5.01860611E+03 5.01860611E+03
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4.88754773E-04 5.03742179E+03 5.03742179E+03
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4.92429706E-04 5.04351101E+03 5.04351101E+03
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4.96104638E-04 5.03725842E+03 5.03725842E+03
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4.99779571E-04 5.01912105E+03 5.01912105E+03
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5.03454503E-04 4.98961297E+03 4.98961297E+03
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5.07129436E-04 4.94929384E+03 4.94929384E+03
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5.10804368E-04 4.89876181E+03 4.89876181E+03
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5.14479301E-04 4.83865107E+03 4.83865107E+03
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5.18154233E-04 4.76963370E+03 4.76963370E+03
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5.21829166E-04 4.69242509E+03 4.69242509E+03
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5.25504099E-04 4.60779194E+03 4.60779194E+03
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5.29179031E-04 4.51656127E+03 4.51656127E+03
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5.32853964E-04 4.41962875E+03 4.41962875E+03
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5.36528896E-04 4.31796467E+03 4.31796467E+03
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5.40203829E-04 4.21261577E+03 4.21261577E+03
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5.43878761E-04 4.10470147E+03 4.10470147E+03
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5.47553694E-04 3.99540348E+03 3.99540348E+03
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5.51228626E-04 3.88594821E+03 3.88594821E+03
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5.54903559E-04 3.77758216E+03 3.77758216E+03
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5.58578491E-04 3.67154090E+03 3.67154090E+03
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5.62253424E-04 3.56901332E+03 3.56901332E+03
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5.65928357E-04 3.47110287E+03 3.47110287E+03
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5.69603289E-04 3.37878841E+03 3.37878841E+03
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5.73278222E-04 3.29288734E+03 3.29288734E+03
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5.76953154E-04 3.21402359E+03 3.21402359E+03
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5.80628087E-04 3.14260304E+03 3.14260304E+03
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5.84303019E-04 3.07879843E+03 3.07879843E+03
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5.87977952E-04 3.02254513E+03 3.02254513E+03
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5.91652884E-04 2.97354843E+03 2.97354843E+03
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5.95327817E-04 2.93130225E+03 2.93130225E+03
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5.99002749E-04 2.89511801E+03 2.89511801E+03
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6.02677682E-04 2.86416223E+03 2.86416223E+03
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6.06352614E-04 2.83750008E+03 2.83750008E+03
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6.10027547E-04 2.81414240E+03 2.81414240E+03
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6.13702480E-04 2.79309305E+03 2.79309305E+03
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6.17377412E-04 2.77339378E+03 2.77339378E+03
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6.21052345E-04 2.75416396E+03 2.75416396E+03
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6.24727277E-04 2.73463329E+03 2.73463329E+03
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6.28402210E-04 2.71416590E+03 2.71416590E+03
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6.32077142E-04 2.69227530E+03 2.69227530E+03
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6.35752075E-04 2.66863009E+03 2.66863009E+03
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6.39427007E-04 2.64305125E+03 2.64305125E+03
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6.43101940E-04 2.61550219E+03 2.61550219E+03
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6.46776872E-04 2.58607308E+03 2.58607308E+03
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6.50451805E-04 2.55496126E+03 2.55496126E+03
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6.54126737E-04 2.52244948E+03 2.52244948E+03
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6.57801670E-04 2.48888356E+03 2.48888356E+03
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6.61476603E-04 2.45465068E+03 2.45465068E+03
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6.65151535E-04 2.42015935E+03 2.42015935E+03
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6.68826468E-04 2.38582156E+03 2.38582156E+03
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6.72501400E-04 2.35203738E+03 2.35203738E+03
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6.76176333E-04 2.31918191E+03 2.31918191E+03
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6.79851265E-04 2.28759454E+03 2.28759454E+03
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6.83526198E-04 2.25757008E+03 2.25757008E+03
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6.87201130E-04 2.22935162E+03 2.22935162E+03
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6.90876063E-04 2.20312503E+03 2.20312503E+03
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