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-.219E+00 -.216E+00 -.214E+00 -.211E+00 -.208E+00 -.206E+00 -.203E+00 -.201E+00 -.198E+00 -.196E+00 -.193E+00 -.191E+00 -.188E+00 -.186E+00 -.184E+00 -.181E+00 -.179E+00 -.177E+00 -.174E+00 -.172E+00 -.170E+00 -.168E+00 -.166E+00 -.164E+00 -.162E+00 -.160E+00 -.158E+00 -.156E+00 -.154E+00 -.152E+00 -.150E+00 -.148E+00 -.146E+00 -.144E+00 1 Si2 ITER DVMAX R VN-1 VN DEMAX DPMAX PN-1 PN eigenwert von 1 Zustand -65.0251147034346 eigenwert von 2 Zustand -4.52900909126609 eigenwert von 3 Zustand -2.92953835634361 eigenwert von 4 Zustand -2.90579357547954 1 2.49E+00 7.717372E-01 -3.967892E+00 -6.454060E+00 7.63E-01 -1.00E+00 0.000000E+00 1.002762E+00 NOMBRE D ITERATIONS SUPERIEUR A 1 1 Si2 RADII AND CHARGE DENS. ALTERNATELY 0.10000000D-03 0.23703881D-03 0.10127777D-03 0.24309389D-03 0.10257187D-03 0.24930354D-03 0.10388251D-03 0.25567167D-03 0.10520989D-03 0.26220235D-03 0.10655423D-03 0.26889971D-03 0.10791575D-03 0.27576801D-03 0.10929467D-03 0.28281159D-03 0.11069121D-03 0.29003493D-03 0.11210559D-03 0.29744262D-03 0.11353804D-03 0.30503934D-03 0.11498880D-03 0.31282991D-03 0.11645810D-03 0.32081929D-03 0.11794617D-03 0.32901253D-03 0.11945325D-03 0.33741483D-03 0.12097959D-03 0.34603152D-03 0.12252544D-03 0.35486805D-03 0.12409103D-03 0.36393004D-03 0.12567663D-03 0.37322322D-03 0.12728249D-03 0.38275349D-03 0.12890888D-03 0.39252689D-03 0.13055604D-03 0.40254961D-03 0.13222425D-03 0.41282799D-03 0.13391377D-03 0.42336857D-03 0.13562489D-03 0.43417800D-03 0.13735786D-03 0.44526314D-03 0.13911298D-03 0.45663101D-03 0.14089053D-03 0.46828882D-03 0.14269079D-03 0.48024394D-03 0.14451406D-03 0.49250394D-03 0.14636062D-03 0.50507660D-03 0.14823077D-03 0.51796986D-03 0.15012482D-03 0.53119189D-03 0.15204308D-03 0.54475107D-03 0.15398584D-03 0.55865596D-03 0.15595343D-03 0.57291538D-03 0.15794616D-03 0.58753835D-03 0.15996435D-03 0.60253412D-03 0.16200834D-03 0.61791218D-03 0.16407843D-03 0.63368225D-03 0.16617498D-03 0.64985431D-03 0.16829832D-03 0.66643859D-03 0.17044879D-03 0.68344559D-03 0.17262674D-03 0.70088604D-03 0.17483251D-03 0.71877098D-03 0.17706648D-03 0.73711172D-03 0.17932898D-03 0.75591984D-03 0.18162040D-03 0.77520724D-03 0.18394110D-03 0.79498611D-03 0.18629144D-03 0.81526894D-03 0.18867183D-03 0.83606855D-03 0.19108262D-03 0.85739808D-03 0.19352422D-03 0.87927099D-03 0.19599702D-03 0.90170111D-03 0.19850142D-03 0.92470260D-03 0.20103782D-03 0.94828999D-03 0.20360662D-03 0.97247815D-03 0.20620825D-03 0.99728236D-03 0.20884312D-03 0.10227183D-02 0.21151166D-03 0.10488020D-02 0.21421430D-03 0.10755499D-02 0.21695147D-03 0.11029788D-02 0.21972362D-03 0.11311062D-02 0.22253119D-03 0.11599497D-02 0.22537463D-03 0.11895275D-02 0.22825440D-03 0.12198583D-02 0.23117098D-03 0.12509612D-02 0.23412482D-03 0.12828558D-02 0.23711640D-03 0.13155621D-02 0.24014621D-03 0.13491009D-02 0.24321473D-03 0.13834932D-02 0.24632246D-03 0.14187607D-02 0.24946990D-03 0.14549255D-02 0.25265756D-03 0.14920106D-02 0.25588595D-03 0.15300392D-02 0.25915559D-03 0.15690353D-02 0.26246701D-03 0.16090233D-02 0.26582074D-03 0.16500285D-02 0.26921732D-03 0.16920767D-02 0.27265731D-03 0.17351944D-02 0.27614125D-03 0.17794085D-02 0.27966970D-03 0.18247470D-02 0.28324325D-03 0.18712383D-02 0.28686245D-03 0.19189117D-02 0.29052790D-03 0.19677971D-02 0.29424019D-03 0.20179252D-02 0.29799991D-03 0.20693276D-02 0.30180767D-03 0.21220364D-02 0.30566408D-03 0.21760849D-02 0.30956977D-03 0.22315069D-02 0.31352537D-03 0.22883372D-02 0.31753151D-03 0.23466115D-02 0.32158884D-03 0.24063664D-02 0.32569802D-03 0.24676393D-02 0.32985970D-03 0.25304687D-02 0.33407455D-03 0.25948939D-02 0.33834327D-03 0.26609553D-02 0.34266652D-03 0.27286944D-02 0.34704502D-03 0.27981536D-02 0.35147947D-03 0.28693764D-02 0.35597058D-03 0.29424073D-02 0.36051907D-03 0.30172922D-02 0.36512568D-03 0.30940779D-02 0.36979116D-03 0.31728124D-02 0.37451625D-03 0.32535450D-02 0.37930172D-03 0.33363263D-02 0.38414833D-03 0.34212079D-02 0.38905687D-03 0.35082430D-02 0.39402813D-03 0.35974858D-02 0.39906292D-03 0.36889923D-02 0.40416203D-03 0.37828196D-02 0.40932630D-03 0.38790262D-02 0.41455656D-03 0.39776722D-02 0.41985365D-03 0.40788193D-02 0.42521843D-03 0.41825304D-02 0.43065175D-03 0.42888703D-02 0.43615450D-03 0.43979054D-02 0.44172756D-03 0.45097035D-02 0.44737184D-03 0.46243344D-02 0.45308823D-03 0.47418695D-02 0.45887767D-03 0.48623820D-02 0.46474108D-03 0.49859469D-02 0.47067941D-03 0.51126411D-02 0.47669363D-03 0.52425436D-02 0.48278469D-03 0.53757350D-02 0.48895358D-03 0.55122983D-02 0.49520129D-03 0.56523183D-02 0.50152884D-03 0.57958820D-02 0.50793724D-03 0.59430786D-02 0.51442752D-03 0.60939996D-02 0.52100073D-03 0.62487386D-02 0.52765794D-03 0.64073916D-02 0.53440020D-03 0.65700572D-02 0.54122862D-03 0.67368361D-02 0.54814429D-03 0.69078317D-02 0.55514833D-03 0.70831500D-02 0.56224186D-03 0.72628996D-02 0.56942603D-03 0.74471918D-02 0.57670200D-03 0.76361407D-02 0.58407094D-03 0.78298631D-02 0.59153404D-03 0.80284789D-02 0.59909250D-03 0.82321110D-02 0.60674754D-03 0.84408850D-02 0.61450039D-03 0.86549300D-02 0.62235231D-03 0.88743781D-02 0.63030456D-03 0.90993648D-02 0.63835842D-03 0.93300289D-02 0.64651519D-03 0.95665126D-02 0.65477618D-03 0.98089616D-02 0.66314273D-03 0.10057525D-01 0.67161618D-03 0.10312357D-01 0.68019791D-03 0.10573613D-01 0.68888929D-03 0.10841455D-01 0.69769173D-03 0.11116047D-01 0.70660664D-03 0.11397558D-01 0.71563547D-03 0.11686160D-01 0.72477966D-03 0.11982032D-01 0.73404070D-03 0.12285355D-01 0.74342007D-03 0.12596314D-01 0.75291929D-03 0.12915100D-01 0.76253988D-03 0.13241910D-01 0.77228341D-03 0.13576942D-01 0.78215143D-03 0.13920402D-01 0.79214555D-03 0.14272500D-01 0.80226737D-03 0.14633452D-01 0.81251852D-03 0.15003478D-01 0.82290066D-03 0.15382804D-01 0.83341546D-03 0.15771662D-01 0.84406461D-03 0.16170289D-01 0.85484984D-03 0.16578927D-01 0.86577287D-03 0.16997827D-01 0.87683548D-03 0.17427243D-01 0.88803944D-03 0.17867436D-01 0.89938657D-03 0.18318674D-01 0.91087868D-03 0.18781233D-01 0.92251764D-03 0.19255391D-01 0.93430532D-03 0.19741438D-01 0.94624361D-03 0.20239669D-01 0.95833445D-03 0.20750385D-01 0.97057979D-03 0.21273896D-01 0.98298159D-03 0.21810519D-01 0.99554186D-03 0.22360579D-01 0.10082626D-02 0.22924408D-01 0.10211459D-02 0.23502347D-01 0.10341938D-02 0.24094744D-01 0.10474085D-02 0.24701959D-01 0.10607920D-02 0.25324356D-01 0.10743465D-02 0.25962310D-01 0.10880742D-02 0.26616206D-01 0.11019773D-02 0.27286437D-01 0.11160581D-02 0.27973406D-01 0.11303188D-02 0.28677526D-01 0.11447617D-02 0.29399219D-01 0.11593891D-02 0.30138918D-01 0.11742035D-02 0.30897066D-01 0.11892071D-02 0.31674117D-01 0.12044025D-02 0.32470537D-01 0.12197920D-02 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0.44072859D-02 0.23291620D+01 0.38179388D-02 0.23589233D+01 0.33019257D-02 0.23890650D+01 0.28509000D-02 0.24195918D+01 0.24573656D-02 0.24505087D+01 0.21146016D-02 0.24818206D+01 0.18165932D-02 0.25135327D+01 0.15579675D-02 0.25456499D+01 0.13339331D-02 0.25781775D+01 0.11402257D-02 0.26111208D+01 0.97305729D-03 0.26444849D+01 0.82906889D-03 0.26782754D+01 0.70528816D-03 0.27124977D+01 0.59908987D-03 0.27471573D+01 0.50816006D-03 0.27822597D+01 0.43046323D-03 0.28178106D+01 0.36421271D-03 0.28538158D+01 0.30784292D-03 0.28902811D+01 0.25998758D-03 0.29272123D+01 0.21944709D-03 0.29646154D+01 0.18520503D-03 0.30024965D+01 0.15627447D-03 0.30408616D+01 0.13225075D-03 0.30797169D+01 0.11131752D-03 0.31190686D+01 0.95190327D-04 0.31589232D+01 0.79244294D-04 0.31992871D+01 0.65112849D-04 0.32401667D+01 0.53371339D-04 0.32815687D+01 0.43639328D-04 0.33234996D+01 0.35592804D-04 ENERGIE (R4) (R2) (R) (R-1) (R-3) 2 1 > COR 0.1735627E+00 0.0000000E+00 0.0000000E+00 0.1735627E+00 1S -6.5025115E+01 7.2068846E-04 1.6677149E-02 1.1127833E-01 1.3639613E+01 2S -4.5290091E+00 2.7696517E-01 3.8602913E-01 5.6815163E-01 2.5807662E+00 2P* -2.9295384E+00 2.9828902E-01 3.6404189E-01 5.3669867E-01 2.4679923E+00 2P -2.9057936E+00 3.0322277E-01 3.6699153E-01 5.3895248E-01 2.4548638E+00 4.7868848E+01 0 ET=-2.5944498E+02 EC= 3.1009338E+02 EE= 1.0867752E+02 EX=-1.7469114E+01 EN=-6.6074678E+02 1 Si2 0 INTEGRALES DE RECOUVREMENT 2S 1S 0.0000000