NRG Ljubljana (c) Rok Zitko, rok.zitko@ijs.si, 2005-2018 Mathematica version: 11.3.0 for Linux x86 (64-bit) (March 7, 2018) sneg version: 1.250 Loading module initialparse.m Options: {} def1ch, NRDOTS=1 COEFCHANNELS:1 H0=coefzeta[1, 0]*(-1 + nc[f[0, 0, 0], f[1, 0, 0]] + nc[f[0, 0, 1], f[1, 0, 1]]) + coefdelta[1, 0]*(-nc[f[0, 0, 0], f[0, 0, 1]] + nc[f[1, 0, 0], f[1, 0, 1]]) adddots, nrdots=1 Loading module models.m "models started" Loading module custommodels.m models $Id: custommodels.m,v 1.1 2015/11/09 12:23:47 rokzitko Exp rokzitko $ custommodels.m done params={gammaPol -> Sqrt[gammaA*theta0]/Sqrt[Pi], gammaPolCh[ch_] :> Sqrt[1/Pi*theta0Ch[ch]*gammaA], hybV[i_, j_] :> Sqrt[1/Pi]*V[i, j], coefzeta[ch_, j__] :> N[bandrescale*zeta[ch][j]], coefxi[ch_, j__] :> N[bandrescale*xi[ch][j]], coefrung[ch_, j__] :> N[bandrescale*zetaR[ch][j]], coefdelta[ch_, j__] :> N[bandrescale*scdelta[ch][j]], coefkappa[ch_, j__] :> N[bandrescale*sckappa[ch][j]], U -> 0.01, delta -> 0, t -> 0., gammaPol2 -> Sqrt[extraGamma2*gammaA*thetaCh[1]]/Sqrt[Pi], gammaPol2to2 -> Sqrt[extraGamma2to2*gammaA*thetaCh[2]]/Sqrt[Pi], gammaPolch1 -> Sqrt[extraGamma1*gammaA*thetaCh[1]]/Sqrt[Pi], gammaPolch2 -> Sqrt[extraGamma2*gammaA*thetaCh[2]]/Sqrt[Pi], gammaPolch3 -> Sqrt[extraGamma3*gammaA*thetaCh[3]]/Sqrt[Pi], Jspin -> extraJspin*gammaA, Jcharge -> extraJcharge*gammaA, Jcharge1 -> extraJcharge1*gammaA, Jcharge2 -> extraJcharge2*gammaA, Jkondo -> extraJkondo*gammaA, Jkondo1 -> extraJkondo1*gammaA, Jkondo2 -> extraJkondo2*gammaA, Jkondo3 -> extraJkondo3*gammaA, Jkondo1P -> extraJkondo1P*gammaA, Jkondo2P -> extraJkondo2P*gammaA, Jkondo1Z -> extraJkondo1Z*gammaA, Jkondo2Z -> extraJkondo2Z*gammaA, JkondoP -> extraJkondoP*gammaA, JkondoZ -> extraJkondoZ*gammaA, Jkondo1ch2 -> extraJkondo1ch2*gammaA, Jkondo2ch2 -> extraJkondo2ch2*gammaA, gep -> extrag, dd -> extrad, hybV11 -> Sqrt[extraGamma11*gammaA*thetaCh[1]]/Sqrt[Pi], hybV12 -> Sqrt[extraGamma12*gammaA*thetaCh[2]]/Sqrt[Pi], hybV21 -> Sqrt[extraGamma21*gammaA*thetaCh[1]]/Sqrt[Pi], hybV22 -> Sqrt[extraGamma22*gammaA*thetaCh[2]]/Sqrt[Pi]} NRDOTS:1 CHANNELS:1 basis:{d[], f[0]} lrchain:{} lrextrarule:{} NROPS:2 Hamiltonian generated. U/2 - coefzeta[1, 0] + delta*nc[d[0, 0], d[1, 0]] - (U*nc[d[0, 0], d[1, 0]])/2 + gammaPolCh[1]*nc[d[0, 0], f[1, 0, 0]] + delta*nc[d[0, 1], d[1, 1]] - (U*nc[d[0, 1], d[1, 1]])/2 + gammaPolCh[1]*nc[d[0, 1], f[1, 0, 1]] + gammaPolCh[1]*nc[f[0, 0, 0], d[1, 0]] - coefdelta[1, 0]*nc[f[0, 0, 0], f[0, 0, 1]] + coefzeta[1, 0]*nc[f[0, 0, 0], f[1, 0, 0]] + gammaPolCh[1]*nc[f[0, 0, 1], d[1, 1]] + coefzeta[1, 0]*nc[f[0, 0, 1], f[1, 0, 1]] + coefdelta[1, 0]*nc[f[1, 0, 0], f[1, 0, 1]] - U*nc[d[0, 0], d[0, 1], d[1, 0], d[1, 1]] H-conj[H]=0 SCALE[0]=1.2131570881878404 faktor=1.1657299587521546 Generating basis Basis states generated. BASIS NR=16 Basis: basis.SIAM..SPSU2 PREC=1000 Tmin=1.*^-10 Tmin=1.*^-10 ==> Nmax=66 DISCNMAX=66 mMAX=132 Diagonalisation. Discretization checksum [-1] (channel 1): 1.0921142544088820340677128502455565538`10.*^-40 BAND="flat" thetaCh={"2."} Discretization (channel 1) "xitable" (channel 1) 0.5874247114 0.5057381329 0.4062030654 0.2949707354 0.2101971291 0.1498498163 0.1065568805 0.07557981328 0.05352798514 0.0378804541 0.02679636 0.01895172987 0.01340225709 0.009477308193 0.006701639126 0.00473883467 0.003350883415 0.002369439912 0.00167544969 0.001184722778 0.0008377258429 0.0005923617419 0.0004188630462 0.000296180915 0.0002094315387 0.000148090463 0.0001047157713 0.0000740452322 0.00005235788589 0.00003702261619 0.00002617894297 0.0000185113081 0.00001308947149 9.255654054e-6 6.544735746e-6 4.627827027e-6 3.272367873e-6 2.313913514e-6 1.636183937e-6 1.156956757e-6 8.180919683e-7 5.784783784e-7 4.090459841e-7 2.892391892e-7 2.045229921e-7 1.446195946e-7 1.02261496e-7 7.23097973e-8 5.113074802e-8 3.615489865e-8 2.556537401e-8 1.807744932e-8 1.2782687e-8 9.038724662e-9 6.391343502e-9 4.519362331e-9 3.195671751e-9 2.259681166e-9 1.597835875e-9 1.129840583e-9 7.989179377e-10 5.649202914e-10 3.994589689e-10 2.824601457e-10 1.997294844e-10 1.412300728e-10 9.986474222e-11 "zetatable" (channel 1) 0.e-999 0.e-998 0.e-997 0.e-996 0.e-996 0.e-995 0.e-994 0.e-993 0.e-992 0.e-991 0.e-991 0.e-990 0.e-989 0.e-988 0.e-987 0.e-986 0.e-986 0.e-985 0.e-984 0.e-983 0.e-982 0.e-981 0.e-980 0.e-980 0.e-979 0.e-978 0.e-977 0.e-976 0.e-975 0.e-975 0.e-974 0.e-973 0.e-972 0.e-971 0.e-970 0.e-969 0.e-969 0.e-968 0.e-967 0.e-966 0.e-965 0.e-964 0.e-964 0.e-963 0.e-962 0.e-961 0.e-960 0.e-959 0.e-958 0.e-958 0.e-957 0.e-956 0.e-955 0.e-954 0.e-953 0.e-953 0.e-952 0.e-951 0.e-950 0.e-949 0.e-948 0.e-948 0.e-947 0.e-946 0.e-945 0.e-944 0.e-943 Precision last xi:933.61604029965 Precision last zeta: 0. "scdeltatable" (channel 1) 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 0.001 "sckappatable" (channel 1) 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Discretization done. --EOF-- {{# Input file for NRG Ljubljana, Rok Zitko, rok.zitko@ijs.si, 2005-2015}, {# symtype , SPSU2}, {# Using sneg version , 1.250}, {#!8}, {# Number of channels, impurities, chain sites, subspaces: }, {1, 1, 66, 3}} maketable[] exnames={d, g, Gamma1, Gamma11, Gamma12, Gamma2, Gamma21, Gamma22, Gamma2to2, Gamma3, Jcharge, Jcharge1, Jcharge2, Jkondo, Jkondo1, Jkondo1ch2, Jkondo1P, Jkondo1Z, Jkondo2, Jkondo2ch2, Jkondo2P, Jkondo2Z, Jkondo3, JkondoP, JkondoZ, Jspin} thetaCh={"2."} theta0Ch={"0.002"} gammaPolCh={"0.025231325220201602"} checkdefinitions[] -> 0.08592530088080641 calcgsenergy[] diagvc[{1}] Generating matrix: ham.SIAM..SPSU2_1 hamil={{(U - 2*coefzeta[1, 0])/2, -coefdelta[1, 0], 0, 0, 0}, {-coefdelta[1, 0], U/2 + coefzeta[1, 0], Sqrt[2]*gammaPolCh[1], 0, 0}, {0, Sqrt[2]*gammaPolCh[1], delta, Sqrt[2]*gammaPolCh[1], 0}, {0, 0, Sqrt[2]*gammaPolCh[1], (4*delta + U - 2*coefzeta[1, 0])/2, -coefdelta[1, 0]}, {0, 0, 0, -coefdelta[1, 0], 2*delta + U/2 + coefzeta[1, 0]}} dim={5, 5} det[vec]=-1. 1-abs=0. orthogonality check=2.1875947234240023*^-15 diagvc[{2}] Generating matrix: ham.SIAM..SPSU2_2 hamil={{U/2, gammaPolCh[1], 0, 0}, {gammaPolCh[1], delta - coefzeta[1, 0], -coefdelta[1, 0], 0}, {0, -coefdelta[1, 0], delta + coefzeta[1, 0], -gammaPolCh[1]}, {0, 0, -gammaPolCh[1], (4*delta + U)/2}} dim={4, 4} det[vec]=1. 1-abs=0. orthogonality check=3.6637359812630166*^-15 diagvc[{3}] Generating matrix: ham.SIAM..SPSU2_3 hamil={{delta}} dim={1, 1} det[vec]=1. 1-abs=0. orthogonality check=0. Lowest energies (absolute):{-0.04803350185216805, -0.02340904902525047, -0.02231046764418986, 0., 0.0040000000000000036, 0.004998037282909628, 0.005999999999999998, 0.027409049025250456, 0.028310467644189846, 0.05303546456925842} Lowest energies (GS shifted):{0., 0.02462445282691758, 0.02572303420797819, 0.04803350185216805, 0.052033501852168054, 0.05303153913507768, 0.05403350185216805, 0.07544255087741851, 0.0763439694963579, 0.10106896642142647} Scale factor SCALE(Ninit):1.2131570881878404 Lowest energies (shifted and scaled):{0., 0.020297827104732564, 0.02120338285819366, 0.03959380225352212, 0.04289098448898597, 0.04371366218887103, 0.044539575606717896, 0.06218695963777552, 0.06292999500204634, 0.08331070016035495} makeireducf GENERAL ireducTable: f[0]{} Loading module operators.m "operators.m started" s: n_d op.SIAM..SPSU2.n_d nc[d[0, 0], d[1, 0]] + nc[d[0, 1], d[1, 1]] s: pair_d op.SIAM..SPSU2.pair_d -nc[d[0, 0], d[0, 1]] d: A_d d ireducTable: d{} ireducTable: (-1)^#2*d[1 - #1, 1 - #2] & {} operators.m done Loading module customoperators.m "customoperators $Id: customoperators.m,v 1.1 2015/11/09 12:23:54 rokzitko Exp rokzitko $" Customoperators done. Loading module modeloperators.m Can't load modeloperators.m. Continuing. -- maketable[] done -- Timing report {basis, 0.009128`4.411920624906129} {ham, 0.0273989999999999999`4.412158451143883} {maketable, 0.256408`5.860476564661215} {xi, 0.878461`6.39526747889386} {_, 0} data gammaPol=0.0252313252202016 "Success!"