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]]) 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]] + 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]] - U*nc[d[0, 0], d[0, 1], d[1, 0], d[1, 1]] H-conj[H]=0 SCALE[0]=1.8204784532536744 faktor=0.9514261508963461 Generating basis Basis states generated. BASIS NR=16 Basis: basis.SIAM..QS PREC=1000 Tmin=1.*^-10 Tmin=1.*^-10 ==> Nmax=43 DISCNMAX=43 mMAX=86 Diagonalisation. Discretization checksum [-1] (channel 1): 5.35810804428070388463484238237536548`10.*^-42 BAND="flat" thetaCh={"2."} Discretization (channel 1) "xitable" (channel 1) 0.6163414322 0.5630970686 0.3957013994 0.2153424145 0.1185006403 0.06766831941 0.03897037357 0.02248299243 0.01297748872 0.007491971962 0.004325379938 0.002497237727 0.001441776729 0.0008324093851 0.0004805916291 0.0002774696769 0.000160197187 0.00009248988792 0.00005339906148 0.00003082996248 0.00001779968713 0.00001027665415 5.933229042e-6 3.425551384e-6 1.977743014e-6 1.141850461e-6 6.592476713e-7 3.806168205e-7 2.197492238e-7 1.268722735e-7 7.324974125e-8 4.229075783e-8 2.441658042e-8 1.409691928e-8 8.138860139e-9 4.698973092e-9 2.71295338e-9 1.566324364e-9 9.043177933e-10 5.221081214e-10 3.014392644e-10 1.740360405e-10 1.004797548e-10 5.801201349e-11 "zetatable" (channel 1) 0.e-999 0.e-998 0.e-997 0.e-997 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-985 0.e-984 0.e-983 0.e-983 0.e-982 0.e-981 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-968 0.e-968 0.e-967 0.e-966 0.e-965 0.e-964 0.e-963 0.e-962 0.e-961 Precision last xi:951.2960673399755 Precision last zeta: 0. Discretization done. --EOF-- {{# Input file for NRG Ljubljana, Rok Zitko, rok.zitko@ijs.si, 2005-2015}, {# symtype , QS}, {# Using sneg version , 1.250}, {#!8}, {# Number of channels, impurities, chain sites, subspaces: }, {1, 1, 43, 6}} 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={"0.0012"} gammaPolCh={"0.019544100476116797"} checkdefinitions[] -> 0.06317640190446719 calcgsenergy[] diagvc[{-2, 1}] Generating matrix: ham.SIAM..QS_-2.1 hamil={{(U - 2*coefzeta[1, 0])/2}} dim={1, 1} det[vec]=1. 1-abs=0. orthogonality check=0. diagvc[{-1, 2}] Generating matrix: ham.SIAM..QS_-1.2 hamil={{U/2, gammaPolCh[1]}, {gammaPolCh[1], delta - coefzeta[1, 0]}} dim={2, 2} det[vec]=-1.0000000000000002 1-abs=-2.220446049250313*^-16 orthogonality check=8.881784197001252*^-16 diagvc[{0, 1}] Generating matrix: ham.SIAM..QS_0.1 hamil={{U/2 + coefzeta[1, 0], Sqrt[2]*gammaPolCh[1], 0}, {Sqrt[2]*gammaPolCh[1], delta, Sqrt[2]*gammaPolCh[1]}, {0, Sqrt[2]*gammaPolCh[1], (4*delta + U - 2*coefzeta[1, 0])/2}} dim={3, 3} det[vec]=1.0000000000000002 1-abs=-2.220446049250313*^-16 orthogonality check=9.992007221626409*^-16 diagvc[{0, 3}] Generating matrix: ham.SIAM..QS_0.3 hamil={{delta}} dim={1, 1} det[vec]=1. 1-abs=0. orthogonality check=0. diagvc[{1, 2}] Generating matrix: ham.SIAM..QS_1.2 hamil={{delta + coefzeta[1, 0], -gammaPolCh[1]}, {-gammaPolCh[1], (4*delta + U)/2}} dim={2, 2} det[vec]=1.0000000000000002 1-abs=-2.220446049250313*^-16 orthogonality check=8.881784197001252*^-16 diagvc[{2, 1}] Generating matrix: ham.SIAM..QS_2.1 hamil={{2*delta + U/2 + coefzeta[1, 0]}} dim={1, 1} det[vec]=1. 1-abs=0. orthogonality check=0. Lowest energies (absolute):{-0.03666806675957081, -0.017203346503082893, -0.01720334650308289, 0., 0.005, 0.005, 0.005000000000000005, 0.02220334650308289, 0.022203346503082894, 0.04166806675957079} Lowest energies (GS shifted):{0., 0.019464720256487916, 0.01946472025648792, 0.03666806675957081, 0.041668066759570806, 0.041668066759570806, 0.04166806675957081, 0.0588714132626537, 0.0588714132626537, 0.0783361335191416} Scale factor SCALE(Ninit):1.8204784532536744 Lowest energies (shifted and scaled):{0., 0.010692090434632356, 0.010692090434632357, 0.020141994371883565, 0.02288852509355384, 0.02288852509355384, 0.022888525093553845, 0.032338429030805055, 0.032338429030805055, 0.04303051946543739} makeireducf GENERAL ireducTable: f[0]{} Loading module operators.m "operators.m started" s: n_d op.SIAM..QS.n_d nc[d[0, 0], d[1, 0]] + nc[d[0, 1], d[1, 1]] s: n_d_ud op.SIAM..QS.n_d_ud -nc[d[0, 0], d[0, 1], d[1, 0], d[1, 1]] s: flm op.SIAM..QS.flm nc[d[0, 0], d[1, 0]] + nc[d[0, 1], d[1, 1]] + 2*nc[d[0, 0], d[0, 1], d[1, 0], d[1, 1]] s: n_d^2 op.SIAM..QS.n_d^2 nc[d[0, 0], d[1, 0]] + nc[d[0, 1], d[1, 1]] - 2*nc[d[0, 0], d[0, 1], d[1, 0], d[1, 1]] s: hop0 op.SIAM..QS.hop0 nc[d[0, 0], f[1, 0, 0]] + nc[d[0, 1], f[1, 0, 1]] + nc[f[0, 0, 0], d[1, 0]] + nc[f[0, 0, 1], d[1, 1]] 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, 0.009923`4.448187984851446} {ham, 0.032417`4.184166564120479} {maketable, 0.386521`6.038718087963416} {xi, 0.528097`6.174258693862433} {_, 0} data gammaPol=0.019544100476116797 "Success!"