MPI PARALLEL VERSION Number of procs: 2 PROGRAM GWL: Version 0.91 PROGRAM GWL: Version 0.91 Number of intervals: 118 Number of intervals for fit: 120 Maximum imaginary time: 11.8 Print whole Sigma: F Maximum state considered: 5 Prefix:ch4 Rows together in FFT: 50 Accurate treatment of conduction states Uses contractions on single states Uses no fft grid for time/space integrations Time grid : 3 Frequency grid : 5 Max frequency : 20. Consider states from: 1 to 5 Maximum number of iterations in minpack: 20000 Number of cycles over minpack: 1 Uses LDA Hartree : T Uses LDA Exchange : T Uses SYMMETRIZED DIELECTRIC MATRIX Head of dielectric matrix from file Treatment of W divergence: 0 Wings of dielectric matrix from file Offset fit : 2 Read vcprim terms from file Calculates the polarization directly from the overlaps Polarization Calculated through Lanczos scheme Self-energy Calculated through Lanczos scheme Convolution done analytically Block length fequency 100 Block length states 5 Block length valence states 4 Block length fequency lc 1 Reduced disk I/O Uses double grid, subdivisions: 10 till : 3 t vectors from Wannier products Use truncated Coulomb interaction Calculate Self-energy through FT Spin multiplicity: 1 Partiallly occpuied states: F min -188 0 1 189 max 0 0 189 189 min pola 0 max pola 94 min state 1 max state 3 min state range 1 max state range 3 DB1 118 DB2 DB3 N: 188 188 Omega: 20. 20. freq: -188 -20. -20. weight: -188 0.1694915254237288 0.1694915254237288 freq: -187 -19.83050847457627 -19.83050847457627 weight: -187 0.1694915254237288 0.1694915254237288 freq: -186 -19.66101694915254 -19.66101694915254 weight: -186 0.1694915254237288 0.1694915254237288 freq: -185 -19.491525423728813 -19.491525423728813 weight: -185 0.1694915254237288 0.1694915254237288 freq: -184 -19.322033898305083 -19.322033898305083 weight: -184 0.1694915254237288 0.1694915254237288 freq: -183 -19.152542372881356 -19.152542372881356 weight: -183 0.1694915254237288 0.1694915254237288 freq: -182 -18.983050847457626 -18.983050847457626 weight: -182 0.1694915254237288 0.1694915254237288 freq: -181 -18.813559322033896 -18.813559322033896 weight: -181 0.1694915254237288 0.1694915254237288 freq: -180 -18.64406779661017 -18.64406779661017 weight: -180 0.1694915254237288 0.1694915254237288 freq: -179 -18.47457627118644 -18.47457627118644 weight: -179 0.1694915254237288 0.1694915254237288 freq: -178 -18.305084745762713 -18.305084745762713 weight: -178 0.1694915254237288 0.1694915254237288 freq: -177 -18.135593220338983 -18.135593220338983 weight: -177 0.1694915254237288 0.1694915254237288 freq: -176 -17.966101694915253 -17.966101694915253 weight: -176 0.1694915254237288 0.1694915254237288 freq: -175 -17.796610169491526 -17.796610169491526 weight: -175 0.1694915254237288 0.1694915254237288 freq: -174 -17.627118644067796 -17.627118644067796 weight: -174 0.1694915254237288 0.1694915254237288 freq: -173 -17.457627118644066 -17.457627118644066 weight: -173 0.1694915254237288 0.1694915254237288 freq: -172 -17.28813559322034 -17.28813559322034 weight: -172 0.1694915254237288 0.1694915254237288 freq: -171 -17.11864406779661 -17.11864406779661 weight: -171 0.1694915254237288 0.1694915254237288 freq: -170 -16.94915254237288 -16.94915254237288 weight: -170 0.1694915254237288 0.1694915254237288 freq: -169 -16.779661016949152 -16.779661016949152 weight: -169 0.1694915254237288 0.1694915254237288 freq: -168 -16.610169491525422 -16.610169491525422 weight: -168 0.1694915254237288 0.1694915254237288 freq: -167 -16.440677966101696 -16.440677966101696 weight: -167 0.1694915254237288 0.1694915254237288 freq: -166 -16.271186440677965 -16.271186440677965 weight: -166 0.1694915254237288 0.1694915254237288 freq: -165 -16.101694915254235 -16.101694915254235 weight: -165 0.1694915254237288 0.1694915254237288 freq: -164 -15.932203389830509 -15.932203389830509 weight: -164 0.1694915254237288 0.1694915254237288 freq: -163 -15.762711864406779 -15.762711864406779 weight: -163 0.1694915254237288 0.1694915254237288 freq: -162 -15.59322033898305 -15.59322033898305 weight: -162 0.1694915254237288 0.1694915254237288 freq: -161 -15.423728813559322 -15.423728813559322 weight: -161 0.1694915254237288 0.1694915254237288 freq: -160 -15.254237288135592 -15.254237288135592 weight: -160 0.1694915254237288 0.1694915254237288 freq: -159 -15.084745762711863 -15.084745762711863 weight: -159 0.1694915254237288 0.1694915254237288 freq: -158 -14.915254237288135 -14.915254237288135 weight: -158 0.1694915254237288 0.1694915254237288 freq: -157 -14.745762711864407 -14.745762711864407 weight: -157 0.1694915254237288 0.1694915254237288 freq: -156 -14.576271186440678 -14.576271186440678 weight: -156 0.1694915254237288 0.1694915254237288 freq: -155 -14.406779661016948 -14.406779661016948 weight: -155 0.1694915254237288 0.1694915254237288 freq: -154 -14.23728813559322 -14.23728813559322 weight: -154 0.1694915254237288 0.1694915254237288 freq: -153 -14.067796610169491 -14.067796610169491 weight: -153 0.1694915254237288 0.1694915254237288 freq: -152 -13.898305084745761 -13.898305084745761 weight: -152 0.1694915254237288 0.1694915254237288 freq: -151 -13.728813559322033 -13.728813559322033 weight: -151 0.1694915254237288 0.1694915254237288 freq: -150 -13.559322033898304 -13.559322033898304 weight: -150 0.1694915254237288 0.1694915254237288 freq: -149 -13.389830508474576 -13.389830508474576 weight: -149 0.1694915254237288 0.1694915254237288 freq: -148 -13.220338983050848 -13.220338983050848 weight: -148 0.1694915254237288 0.1694915254237288 freq: -147 -13.050847457627118 -13.050847457627118 weight: -147 0.1694915254237288 0.1694915254237288 freq: -146 -12.88135593220339 -12.88135593220339 weight: -146 0.1694915254237288 0.1694915254237288 freq: -145 -12.711864406779661 -12.711864406779661 weight: -145 0.1694915254237288 0.1694915254237288 freq: -144 -12.54237288135593 -12.54237288135593 weight: -144 0.1694915254237288 0.1694915254237288 freq: -143 -12.372881355932202 -12.372881355932202 weight: -143 0.1694915254237288 0.1694915254237288 freq: -142 -12.203389830508474 -12.203389830508474 weight: -142 0.1694915254237288 0.1694915254237288 freq: -141 -12.033898305084746 -12.033898305084746 weight: -141 0.1694915254237288 0.1694915254237288 freq: -140 -11.864406779661017 -11.864406779661017 weight: -140 0.1694915254237288 0.1694915254237288 freq: -139 -11.694915254237287 -11.694915254237287 weight: -139 0.1694915254237288 0.1694915254237288 freq: -138 -11.525423728813559 -11.525423728813559 weight: -138 0.1694915254237288 0.1694915254237288 freq: -137 -11.35593220338983 -11.35593220338983 weight: -137 0.1694915254237288 0.1694915254237288 freq: -136 -11.1864406779661 -11.1864406779661 weight: -136 0.1694915254237288 0.1694915254237288 freq: -135 -11.016949152542372 -11.016949152542372 weight: -135 0.1694915254237288 0.1694915254237288 freq: -134 -10.847457627118644 -10.847457627118644 weight: -134 0.1694915254237288 0.1694915254237288 freq: -133 -10.677966101694915 -10.677966101694915 weight: -133 0.1694915254237288 0.1694915254237288 freq: -132 -10.508474576271187 -10.508474576271187 weight: -132 0.1694915254237288 0.1694915254237288 freq: -131 -10.338983050847457 -10.338983050847457 weight: -131 0.1694915254237288 0.1694915254237288 freq: -130 -10.169491525423728 -10.169491525423728 weight: -130 0.1694915254237288 0.1694915254237288 freq: -129 -10. -10. weight: -129 0.1694915254237288 0.1694915254237288 freq: -128 -9.83050847457627 -9.83050847457627 weight: -128 0.1694915254237288 0.1694915254237288 freq: -127 -9.661016949152541 -9.661016949152541 weight: -127 0.1694915254237288 0.1694915254237288 freq: -126 -9.491525423728813 -9.491525423728813 weight: -126 0.1694915254237288 0.1694915254237288 freq: -125 -9.322033898305085 -9.322033898305085 weight: -125 0.1694915254237288 0.1694915254237288 freq: -124 -9.152542372881356 -9.152542372881356 weight: -124 0.1694915254237288 0.1694915254237288 freq: -123 -8.983050847457626 -8.983050847457626 weight: -123 0.1694915254237288 0.1694915254237288 freq: -122 -8.813559322033898 -8.813559322033898 weight: -122 0.1694915254237288 0.1694915254237288 freq: -121 -8.64406779661017 -8.64406779661017 weight: -121 0.1694915254237288 0.1694915254237288 freq: -120 -8.47457627118644 -8.47457627118644 weight: -120 0.1694915254237288 0.1694915254237288 freq: -119 -8.305084745762711 -8.305084745762711 weight: -119 0.1694915254237288 0.1694915254237288 freq: -118 -8.135593220338983 -8.135593220338983 weight: -118 0.1694915254237288 0.1694915254237288 freq: -117 -7.966101694915254 -7.966101694915254 weight: -117 0.1694915254237288 0.1694915254237288 freq: -116 -7.796610169491525 -7.796610169491525 weight: -116 0.1694915254237288 0.1694915254237288 freq: -115 -7.627118644067796 -7.627118644067796 weight: -115 0.1694915254237288 0.1694915254237288 freq: -114 -7.4576271186440675 -7.4576271186440675 weight: -114 0.1694915254237288 0.1694915254237288 freq: -113 -7.288135593220339 -7.288135593220339 weight: -113 0.1694915254237288 0.1694915254237288 freq: -112 -7.11864406779661 -7.11864406779661 weight: -112 0.1694915254237288 0.1694915254237288 freq: -111 -6.949152542372881 -6.949152542372881 weight: -111 0.1694915254237288 0.1694915254237288 freq: -110 -6.779661016949152 -6.779661016949152 weight: -110 0.1694915254237288 0.1694915254237288 freq: -109 -6.610169491525424 -6.610169491525424 weight: -109 0.1694915254237288 0.1694915254237288 freq: -108 -6.440677966101695 -6.440677966101695 weight: -108 0.1694915254237288 0.1694915254237288 freq: -107 -6.271186440677965 -6.271186440677965 weight: -107 0.1694915254237288 0.1694915254237288 freq: -106 -6.101694915254237 -6.101694915254237 weight: -106 0.1694915254237288 0.1694915254237288 freq: -105 -5.932203389830509 -5.932203389830509 weight: -105 0.1694915254237288 0.1694915254237288 freq: -104 -5.762711864406779 -5.762711864406779 weight: -104 0.1694915254237288 0.1694915254237288 freq: -103 -5.59322033898305 -5.59322033898305 weight: -103 0.1694915254237288 0.1694915254237288 freq: -102 -5.423728813559322 -5.423728813559322 weight: -102 0.1694915254237288 0.1694915254237288 freq: -101 -5.254237288135593 -5.254237288135593 weight: -101 0.1694915254237288 0.1694915254237288 freq: -100 -5.084745762711864 -5.084745762711864 weight: -100 0.1694915254237288 0.1694915254237288 freq: -99 -4.915254237288135 -4.915254237288135 weight: -99 0.1694915254237288 0.1694915254237288 freq: -98 -4.745762711864407 -4.745762711864407 weight: -98 0.1694915254237288 0.1694915254237288 freq: -97 -4.576271186440678 -4.576271186440678 weight: -97 0.1694915254237288 0.1694915254237288 freq: -96 -4.406779661016949 -4.406779661016949 weight: -96 0.1694915254237288 0.1694915254237288 freq: -95 -4.23728813559322 -4.23728813559322 weight: -95 0.1694915254237288 0.1694915254237288 freq: -94 -4.067796610169491 -4.067796610169491 weight: -94 0.1694915254237288 0.1694915254237288 freq: -93 -3.8983050847457625 -3.8983050847457625 weight: -93 0.1694915254237288 0.1694915254237288 freq: -92 -3.7288135593220337 -3.7288135593220337 weight: -92 0.1694915254237288 0.1694915254237288 freq: -91 -3.559322033898305 -3.559322033898305 weight: -91 0.1694915254237288 0.1694915254237288 freq: -90 -3.389830508474576 -3.389830508474576 weight: -90 0.1694915254237288 0.1694915254237288 freq: -89 -3.2203389830508473 -3.2203389830508473 weight: -89 0.1694915254237288 0.1694915254237288 freq: -88 -3.0508474576271185 -3.0508474576271185 weight: -88 0.1694915254237288 0.1694915254237288 freq: -87 -2.8813559322033897 -2.8813559322033897 weight: -87 0.1694915254237288 0.1694915254237288 freq: -86 -2.711864406779661 -2.711864406779661 weight: -86 0.1694915254237288 0.1694915254237288 freq: -85 -2.542372881355932 -2.542372881355932 weight: -85 0.1694915254237288 0.1694915254237288 freq: -84 -2.3728813559322033 -2.3728813559322033 weight: -84 0.1694915254237288 0.1694915254237288 freq: -83 -2.2033898305084745 -2.2033898305084745 weight: -83 0.1694915254237288 0.1694915254237288 freq: -82 -2.0338983050847457 -2.0338983050847457 weight: -82 0.1694915254237288 0.1694915254237288 freq: -81 -1.8644067796610169 -1.8644067796610169 weight: -81 0.1694915254237288 0.1694915254237288 freq: -80 -1.694915254237288 -1.694915254237288 weight: -80 0.1694915254237288 0.1694915254237288 freq: -79 -1.5254237288135593 -1.5254237288135593 weight: -79 0.1694915254237288 0.1694915254237288 freq: -78 -1.3559322033898304 -1.3559322033898304 weight: -78 0.1694915254237288 0.1694915254237288 freq: -77 -1.1864406779661016 -1.1864406779661016 weight: -77 0.1694915254237288 0.1694915254237288 freq: -76 -1.0169491525423728 -1.0169491525423728 weight: -76 0.1694915254237288 0.1694915254237288 freq: -75 -0.847457627118644 -0.847457627118644 weight: -75 0.1694915254237288 0.1694915254237288 freq: -74 -0.6779661016949152 -0.6779661016949152 weight: -74 0.1694915254237288 0.1694915254237288 freq: -73 -0.5889830508474576 -0.5889830508474576 weight: -73 0.00847457627118644 0.00847457627118644 freq: -72 -0.5805084745762712 -0.5805084745762712 weight: -72 0.00847457627118644 0.00847457627118644 freq: -71 -0.5720338983050848 -0.5720338983050848 weight: -71 0.00847457627118644 0.00847457627118644 freq: -70 -0.5635593220338984 -0.5635593220338984 weight: -70 0.00847457627118644 0.00847457627118644 freq: -69 -0.5550847457627118 -0.5550847457627118 weight: -69 0.00847457627118644 0.00847457627118644 freq: -68 -0.5466101694915254 -0.5466101694915254 weight: -68 0.00847457627118644 0.00847457627118644 freq: -67 -0.538135593220339 -0.538135593220339 weight: -67 0.00847457627118644 0.00847457627118644 freq: -66 -0.5296610169491526 -0.5296610169491526 weight: -66 0.00847457627118644 0.00847457627118644 freq: -65 -0.5211864406779662 -0.5211864406779662 weight: -65 0.00847457627118644 0.00847457627118644 freq: -64 -0.5127118644067796 -0.5127118644067796 weight: -64 0.00847457627118644 0.00847457627118644 freq: -63 -0.5084745762711864 -0.5084745762711864 weight: -63 0. 0. freq: -62 -0.5042372881355932 -0.5042372881355932 weight: -62 0.00847457627118644 0.00847457627118644 freq: -61 -0.4957627118644068 -0.4957627118644068 weight: -61 0.00847457627118644 0.00847457627118644 freq: -60 -0.4872881355932204 -0.4872881355932204 weight: -60 0.00847457627118644 0.00847457627118644 freq: -59 -0.4788135593220339 -0.4788135593220339 weight: -59 0.00847457627118644 0.00847457627118644 freq: -58 -0.4703389830508475 -0.4703389830508475 weight: -58 0.00847457627118644 0.00847457627118644 freq: -57 -0.461864406779661 -0.461864406779661 weight: -57 0.00847457627118644 0.00847457627118644 freq: -56 -0.4533898305084746 -0.4533898305084746 weight: -56 0.00847457627118644 0.00847457627118644 freq: -55 -0.44491525423728817 -0.44491525423728817 weight: -55 0.00847457627118644 0.00847457627118644 freq: -54 -0.4364406779661017 -0.4364406779661017 weight: -54 0.00847457627118644 0.00847457627118644 freq: -53 -0.4279661016949153 -0.4279661016949153 weight: -53 0.00847457627118644 0.00847457627118644 freq: -52 -0.4194915254237288 -0.4194915254237288 weight: -52 0.00847457627118644 0.00847457627118644 freq: -51 -0.4110169491525424 -0.4110169491525424 weight: -51 0.00847457627118644 0.00847457627118644 freq: -50 -0.40254237288135597 -0.40254237288135597 weight: -50 0.00847457627118644 0.00847457627118644 freq: -49 -0.3940677966101695 -0.3940677966101695 weight: -49 0.00847457627118644 0.00847457627118644 freq: -48 -0.3855932203389831 -0.3855932203389831 weight: -48 0.00847457627118644 0.00847457627118644 freq: -47 -0.3771186440677966 -0.3771186440677966 weight: -47 0.00847457627118644 0.00847457627118644 freq: -46 -0.3686440677966102 -0.3686440677966102 weight: -46 0.00847457627118644 0.00847457627118644 freq: -45 -0.3601694915254237 -0.3601694915254237 weight: -45 0.00847457627118644 0.00847457627118644 freq: -44 -0.3516949152542373 -0.3516949152542373 weight: -44 0.00847457627118644 0.00847457627118644 freq: -43 -0.3432203389830509 -0.3432203389830509 weight: -43 0.00847457627118644 0.00847457627118644 freq: -42 -0.3389830508474576 -0.3389830508474576 weight: -42 0. 0. freq: -41 -0.3347457627118644 -0.3347457627118644 weight: -41 0.00847457627118644 0.00847457627118644 freq: -40 -0.326271186440678 -0.326271186440678 weight: -40 0.00847457627118644 0.00847457627118644 freq: -39 -0.3177966101694915 -0.3177966101694915 weight: -39 0.00847457627118644 0.00847457627118644 freq: -38 -0.3093220338983051 -0.3093220338983051 weight: -38 0.00847457627118644 0.00847457627118644 freq: -37 -0.3008474576271187 -0.3008474576271187 weight: -37 0.00847457627118644 0.00847457627118644 freq: -36 -0.2923728813559322 -0.2923728813559322 weight: -36 0.00847457627118644 0.00847457627118644 freq: -35 -0.2838983050847458 -0.2838983050847458 weight: -35 0.00847457627118644 0.00847457627118644 freq: -34 -0.2754237288135593 -0.2754237288135593 weight: -34 0.00847457627118644 0.00847457627118644 freq: -33 -0.2669491525423729 -0.2669491525423729 weight: -33 0.00847457627118644 0.00847457627118644 freq: -32 -0.2584745762711865 -0.2584745762711865 weight: -32 0.00847457627118644 0.00847457627118644 freq: -31 -0.25 -0.25 weight: -31 0.00847457627118644 0.00847457627118644 freq: -30 -0.24152542372881358 -0.24152542372881358 weight: -30 0.00847457627118644 0.00847457627118644 freq: -29 -0.23305084745762714 -0.23305084745762714 weight: -29 0.00847457627118644 0.00847457627118644 freq: -28 -0.2245762711864407 -0.2245762711864407 weight: -28 0.00847457627118644 0.00847457627118644 freq: -27 -0.21610169491525424 -0.21610169491525424 weight: -27 0.00847457627118644 0.00847457627118644 freq: -26 -0.2076271186440678 -0.2076271186440678 weight: -26 0.00847457627118644 0.00847457627118644 freq: -25 -0.19915254237288138 -0.19915254237288138 weight: -25 0.00847457627118644 0.00847457627118644 freq: -24 -0.19067796610169493 -0.19067796610169493 weight: -24 0.00847457627118644 0.00847457627118644 freq: -23 -0.1822033898305085 -0.1822033898305085 weight: -23 0.00847457627118644 0.00847457627118644 freq: -22 -0.17372881355932204 -0.17372881355932204 weight: -22 0.00847457627118644 0.00847457627118644 freq: -21 -0.1694915254237288 -0.1694915254237288 weight: -21 0. 0. freq: -20 -0.1652542372881356 -0.1652542372881356 weight: -20 0.00847457627118644 0.00847457627118644 freq: -19 -0.15677966101694915 -0.15677966101694915 weight: -19 0.00847457627118644 0.00847457627118644 freq: -18 -0.14830508474576273 -0.14830508474576273 weight: -18 0.00847457627118644 0.00847457627118644 freq: -17 -0.1398305084745763 -0.1398305084745763 weight: -17 0.00847457627118644 0.00847457627118644 freq: -16 -0.13135593220338984 -0.13135593220338984 weight: -16 0.00847457627118644 0.00847457627118644 freq: -15 -0.12288135593220338 -0.12288135593220338 weight: -15 0.00847457627118644 0.00847457627118644 freq: -14 -0.11440677966101695 -0.11440677966101695 weight: -14 0.00847457627118644 0.00847457627118644 freq: -13 -0.1059322033898305 -0.1059322033898305 weight: -13 0.00847457627118644 0.00847457627118644 freq: -12 -0.09745762711864407 -0.09745762711864407 weight: -12 0.00847457627118644 0.00847457627118644 freq: -11 -0.08898305084745763 -0.08898305084745763 weight: -11 0.00847457627118644 0.00847457627118644 freq: -10 -0.08050847457627118 -0.08050847457627118 weight: -10 0.00847457627118644 0.00847457627118644 freq: -9 -0.07203389830508475 -0.07203389830508475 weight: -9 0.00847457627118644 0.00847457627118644 freq: -8 -0.0635593220338983 -0.0635593220338983 weight: -8 0.00847457627118644 0.00847457627118644 freq: -7 -0.05508474576271186 -0.05508474576271186 weight: -7 0.00847457627118644 0.00847457627118644 freq: -6 -0.046610169491525424 -0.046610169491525424 weight: -6 0.00847457627118644 0.00847457627118644 freq: -5 -0.03813559322033898 -0.03813559322033898 weight: -5 0.00847457627118644 0.00847457627118644 freq: -4 -0.029661016949152543 -0.029661016949152543 weight: -4 0.00847457627118644 0.00847457627118644 freq: -3 -0.021186440677966104 -0.021186440677966104 weight: -3 0.00847457627118644 0.00847457627118644 freq: -2 -0.012711864406779662 -0.012711864406779662 weight: -2 0.00847457627118644 0.00847457627118644 freq: -1 -0.00423728813559322 -0.00423728813559322 weight: -1 0.00847457627118644 0.00847457627118644 freq: 0 0. 0. weight: 0 0. 0. freq: 1 0.00423728813559322 0.00423728813559322 weight: 1 0.00847457627118644 0.00847457627118644 freq: 2 0.012711864406779662 0.012711864406779662 weight: 2 0.00847457627118644 0.00847457627118644 freq: 3 0.021186440677966104 0.021186440677966104 weight: 3 0.00847457627118644 0.00847457627118644 freq: 4 0.029661016949152543 0.029661016949152543 weight: 4 0.00847457627118644 0.00847457627118644 freq: 5 0.03813559322033898 0.03813559322033898 weight: 5 0.00847457627118644 0.00847457627118644 freq: 6 0.046610169491525424 0.046610169491525424 weight: 6 0.00847457627118644 0.00847457627118644 freq: 7 0.05508474576271186 0.05508474576271186 weight: 7 0.00847457627118644 0.00847457627118644 freq: 8 0.0635593220338983 0.0635593220338983 weight: 8 0.00847457627118644 0.00847457627118644 freq: 9 0.07203389830508475 0.07203389830508475 weight: 9 0.00847457627118644 0.00847457627118644 freq: 10 0.08050847457627118 0.08050847457627118 weight: 10 0.00847457627118644 0.00847457627118644 freq: 11 0.08898305084745763 0.08898305084745763 weight: 11 0.00847457627118644 0.00847457627118644 freq: 12 0.09745762711864407 0.09745762711864407 weight: 12 0.00847457627118644 0.00847457627118644 freq: 13 0.1059322033898305 0.1059322033898305 weight: 13 0.00847457627118644 0.00847457627118644 freq: 14 0.11440677966101695 0.11440677966101695 weight: 14 0.00847457627118644 0.00847457627118644 freq: 15 0.12288135593220338 0.12288135593220338 weight: 15 0.00847457627118644 0.00847457627118644 freq: 16 0.13135593220338984 0.13135593220338984 weight: 16 0.00847457627118644 0.00847457627118644 freq: 17 0.1398305084745763 0.1398305084745763 weight: 17 0.00847457627118644 0.00847457627118644 freq: 18 0.14830508474576273 0.14830508474576273 weight: 18 0.00847457627118644 0.00847457627118644 freq: 19 0.15677966101694915 0.15677966101694915 weight: 19 0.00847457627118644 0.00847457627118644 freq: 20 0.1652542372881356 0.1652542372881356 weight: 20 0.00847457627118644 0.00847457627118644 freq: 21 0.1694915254237288 0.1694915254237288 weight: 21 0. 0. freq: 22 0.17372881355932204 0.17372881355932204 weight: 22 0.00847457627118644 0.00847457627118644 freq: 23 0.1822033898305085 0.1822033898305085 weight: 23 0.00847457627118644 0.00847457627118644 freq: 24 0.19067796610169493 0.19067796610169493 weight: 24 0.00847457627118644 0.00847457627118644 freq: 25 0.19915254237288138 0.19915254237288138 weight: 25 0.00847457627118644 0.00847457627118644 freq: 26 0.2076271186440678 0.2076271186440678 weight: 26 0.00847457627118644 0.00847457627118644 freq: 27 0.21610169491525424 0.21610169491525424 weight: 27 0.00847457627118644 0.00847457627118644 freq: 28 0.2245762711864407 0.2245762711864407 weight: 28 0.00847457627118644 0.00847457627118644 freq: 29 0.23305084745762714 0.23305084745762714 weight: 29 0.00847457627118644 0.00847457627118644 freq: 30 0.24152542372881358 0.24152542372881358 weight: 30 0.00847457627118644 0.00847457627118644 freq: 31 0.25 0.25 weight: 31 0.00847457627118644 0.00847457627118644 freq: 32 0.2584745762711865 0.2584745762711865 weight: 32 0.00847457627118644 0.00847457627118644 freq: 33 0.2669491525423729 0.2669491525423729 weight: 33 0.00847457627118644 0.00847457627118644 freq: 34 0.2754237288135593 0.2754237288135593 weight: 34 0.00847457627118644 0.00847457627118644 freq: 35 0.2838983050847458 0.2838983050847458 weight: 35 0.00847457627118644 0.00847457627118644 freq: 36 0.2923728813559322 0.2923728813559322 weight: 36 0.00847457627118644 0.00847457627118644 freq: 37 0.3008474576271187 0.3008474576271187 weight: 37 0.00847457627118644 0.00847457627118644 freq: 38 0.3093220338983051 0.3093220338983051 weight: 38 0.00847457627118644 0.00847457627118644 freq: 39 0.3177966101694915 0.3177966101694915 weight: 39 0.00847457627118644 0.00847457627118644 freq: 40 0.326271186440678 0.326271186440678 weight: 40 0.00847457627118644 0.00847457627118644 freq: 41 0.3347457627118644 0.3347457627118644 weight: 41 0.00847457627118644 0.00847457627118644 freq: 42 0.3389830508474576 0.3389830508474576 weight: 42 0. 0. freq: 43 0.3432203389830509 0.3432203389830509 weight: 43 0.00847457627118644 0.00847457627118644 freq: 44 0.3516949152542373 0.3516949152542373 weight: 44 0.00847457627118644 0.00847457627118644 freq: 45 0.3601694915254237 0.3601694915254237 weight: 45 0.00847457627118644 0.00847457627118644 freq: 46 0.3686440677966102 0.3686440677966102 weight: 46 0.00847457627118644 0.00847457627118644 freq: 47 0.3771186440677966 0.3771186440677966 weight: 47 0.00847457627118644 0.00847457627118644 freq: 48 0.3855932203389831 0.3855932203389831 weight: 48 0.00847457627118644 0.00847457627118644 freq: 49 0.3940677966101695 0.3940677966101695 weight: 49 0.00847457627118644 0.00847457627118644 freq: 50 0.40254237288135597 0.40254237288135597 weight: 50 0.00847457627118644 0.00847457627118644 freq: 51 0.4110169491525424 0.4110169491525424 weight: 51 0.00847457627118644 0.00847457627118644 freq: 52 0.4194915254237288 0.4194915254237288 weight: 52 0.00847457627118644 0.00847457627118644 freq: 53 0.4279661016949153 0.4279661016949153 weight: 53 0.00847457627118644 0.00847457627118644 freq: 54 0.4364406779661017 0.4364406779661017 weight: 54 0.00847457627118644 0.00847457627118644 freq: 55 0.44491525423728817 0.44491525423728817 weight: 55 0.00847457627118644 0.00847457627118644 freq: 56 0.4533898305084746 0.4533898305084746 weight: 56 0.00847457627118644 0.00847457627118644 freq: 57 0.461864406779661 0.461864406779661 weight: 57 0.00847457627118644 0.00847457627118644 freq: 58 0.4703389830508475 0.4703389830508475 weight: 58 0.00847457627118644 0.00847457627118644 freq: 59 0.4788135593220339 0.4788135593220339 weight: 59 0.00847457627118644 0.00847457627118644 freq: 60 0.4872881355932204 0.4872881355932204 weight: 60 0.00847457627118644 0.00847457627118644 freq: 61 0.4957627118644068 0.4957627118644068 weight: 61 0.00847457627118644 0.00847457627118644 freq: 62 0.5042372881355932 0.5042372881355932 weight: 62 0.00847457627118644 0.00847457627118644 freq: 63 0.5084745762711864 0.5084745762711864 weight: 63 0. 0. freq: 64 0.5127118644067796 0.5127118644067796 weight: 64 0.00847457627118644 0.00847457627118644 freq: 65 0.5211864406779662 0.5211864406779662 weight: 65 0.00847457627118644 0.00847457627118644 freq: 66 0.5296610169491526 0.5296610169491526 weight: 66 0.00847457627118644 0.00847457627118644 freq: 67 0.538135593220339 0.538135593220339 weight: 67 0.00847457627118644 0.00847457627118644 freq: 68 0.5466101694915254 0.5466101694915254 weight: 68 0.00847457627118644 0.00847457627118644 freq: 69 0.5550847457627118 0.5550847457627118 weight: 69 0.00847457627118644 0.00847457627118644 freq: 70 0.5635593220338984 0.5635593220338984 weight: 70 0.00847457627118644 0.00847457627118644 freq: 71 0.5720338983050848 0.5720338983050848 weight: 71 0.00847457627118644 0.00847457627118644 freq: 72 0.5805084745762712 0.5805084745762712 weight: 72 0.00847457627118644 0.00847457627118644 freq: 73 0.5889830508474576 0.5889830508474576 weight: 73 0.00847457627118644 0.00847457627118644 freq: 74 0.6779661016949152 0.6779661016949152 weight: 74 0.1694915254237288 0.1694915254237288 freq: 75 0.847457627118644 0.847457627118644 weight: 75 0.1694915254237288 0.1694915254237288 freq: 76 1.0169491525423728 1.0169491525423728 weight: 76 0.1694915254237288 0.1694915254237288 freq: 77 1.1864406779661016 1.1864406779661016 weight: 77 0.1694915254237288 0.1694915254237288 freq: 78 1.3559322033898304 1.3559322033898304 weight: 78 0.1694915254237288 0.1694915254237288 freq: 79 1.5254237288135593 1.5254237288135593 weight: 79 0.1694915254237288 0.1694915254237288 freq: 80 1.694915254237288 1.694915254237288 weight: 80 0.1694915254237288 0.1694915254237288 freq: 81 1.8644067796610169 1.8644067796610169 weight: 81 0.1694915254237288 0.1694915254237288 freq: 82 2.0338983050847457 2.0338983050847457 weight: 82 0.1694915254237288 0.1694915254237288 freq: 83 2.2033898305084745 2.2033898305084745 weight: 83 0.1694915254237288 0.1694915254237288 freq: 84 2.3728813559322033 2.3728813559322033 weight: 84 0.1694915254237288 0.1694915254237288 freq: 85 2.542372881355932 2.542372881355932 weight: 85 0.1694915254237288 0.1694915254237288 freq: 86 2.711864406779661 2.711864406779661 weight: 86 0.1694915254237288 0.1694915254237288 freq: 87 2.8813559322033897 2.8813559322033897 weight: 87 0.1694915254237288 0.1694915254237288 freq: 88 3.0508474576271185 3.0508474576271185 weight: 88 0.1694915254237288 0.1694915254237288 freq: 89 3.2203389830508473 3.2203389830508473 weight: 89 0.1694915254237288 0.1694915254237288 freq: 90 3.389830508474576 3.389830508474576 weight: 90 0.1694915254237288 0.1694915254237288 freq: 91 3.559322033898305 3.559322033898305 weight: 91 0.1694915254237288 0.1694915254237288 freq: 92 3.7288135593220337 3.7288135593220337 weight: 92 0.1694915254237288 0.1694915254237288 freq: 93 3.8983050847457625 3.8983050847457625 weight: 93 0.1694915254237288 0.1694915254237288 freq: 94 4.067796610169491 4.067796610169491 weight: 94 0.1694915254237288 0.1694915254237288 freq: 95 4.23728813559322 4.23728813559322 weight: 95 0.1694915254237288 0.1694915254237288 freq: 96 4.406779661016949 4.406779661016949 weight: 96 0.1694915254237288 0.1694915254237288 freq: 97 4.576271186440678 4.576271186440678 weight: 97 0.1694915254237288 0.1694915254237288 freq: 98 4.745762711864407 4.745762711864407 weight: 98 0.1694915254237288 0.1694915254237288 freq: 99 4.915254237288135 4.915254237288135 weight: 99 0.1694915254237288 0.1694915254237288 freq: 100 5.084745762711864 5.084745762711864 weight: 100 0.1694915254237288 0.1694915254237288 freq: 101 5.254237288135593 5.254237288135593 weight: 101 0.1694915254237288 0.1694915254237288 freq: 102 5.423728813559322 5.423728813559322 weight: 102 0.1694915254237288 0.1694915254237288 freq: 103 5.59322033898305 5.59322033898305 weight: 103 0.1694915254237288 0.1694915254237288 freq: 104 5.762711864406779 5.762711864406779 weight: 104 0.1694915254237288 0.1694915254237288 freq: 105 5.932203389830509 5.932203389830509 weight: 105 0.1694915254237288 0.1694915254237288 freq: 106 6.101694915254237 6.101694915254237 weight: 106 0.1694915254237288 0.1694915254237288 freq: 107 6.271186440677965 6.271186440677965 weight: 107 0.1694915254237288 0.1694915254237288 freq: 108 6.440677966101695 6.440677966101695 weight: 108 0.1694915254237288 0.1694915254237288 freq: 109 6.610169491525424 6.610169491525424 weight: 109 0.1694915254237288 0.1694915254237288 freq: 110 6.779661016949152 6.779661016949152 weight: 110 0.1694915254237288 0.1694915254237288 freq: 111 6.949152542372881 6.949152542372881 weight: 111 0.1694915254237288 0.1694915254237288 freq: 112 7.11864406779661 7.11864406779661 weight: 112 0.1694915254237288 0.1694915254237288 freq: 113 7.288135593220339 7.288135593220339 weight: 113 0.1694915254237288 0.1694915254237288 freq: 114 7.4576271186440675 7.4576271186440675 weight: 114 0.1694915254237288 0.1694915254237288 freq: 115 7.627118644067796 7.627118644067796 weight: 115 0.1694915254237288 0.1694915254237288 freq: 116 7.796610169491525 7.796610169491525 weight: 116 0.1694915254237288 0.1694915254237288 freq: 117 7.966101694915254 7.966101694915254 weight: 117 0.1694915254237288 0.1694915254237288 freq: 118 8.135593220338983 8.135593220338983 weight: 118 0.1694915254237288 0.1694915254237288 freq: 119 8.305084745762711 8.305084745762711 weight: 119 0.1694915254237288 0.1694915254237288 freq: 120 8.47457627118644 8.47457627118644 weight: 120 0.1694915254237288 0.1694915254237288 freq: 121 8.64406779661017 8.64406779661017 weight: 121 0.1694915254237288 0.1694915254237288 freq: 122 8.813559322033898 8.813559322033898 weight: 122 0.1694915254237288 0.1694915254237288 freq: 123 8.983050847457626 8.983050847457626 weight: 123 0.1694915254237288 0.1694915254237288 freq: 124 9.152542372881356 9.152542372881356 weight: 124 0.1694915254237288 0.1694915254237288 freq: 125 9.322033898305085 9.322033898305085 weight: 125 0.1694915254237288 0.1694915254237288 freq: 126 9.491525423728813 9.491525423728813 weight: 126 0.1694915254237288 0.1694915254237288 freq: 127 9.661016949152541 9.661016949152541 weight: 127 0.1694915254237288 0.1694915254237288 freq: 128 9.83050847457627 9.83050847457627 weight: 128 0.1694915254237288 0.1694915254237288 freq: 129 10. 10. weight: 129 0.1694915254237288 0.1694915254237288 freq: 130 10.169491525423728 10.169491525423728 weight: 130 0.1694915254237288 0.1694915254237288 freq: 131 10.338983050847457 10.338983050847457 weight: 131 0.1694915254237288 0.1694915254237288 freq: 132 10.508474576271187 10.508474576271187 weight: 132 0.1694915254237288 0.1694915254237288 freq: 133 10.677966101694915 10.677966101694915 weight: 133 0.1694915254237288 0.1694915254237288 freq: 134 10.847457627118644 10.847457627118644 weight: 134 0.1694915254237288 0.1694915254237288 freq: 135 11.016949152542372 11.016949152542372 weight: 135 0.1694915254237288 0.1694915254237288 freq: 136 11.1864406779661 11.1864406779661 weight: 136 0.1694915254237288 0.1694915254237288 freq: 137 11.35593220338983 11.35593220338983 weight: 137 0.1694915254237288 0.1694915254237288 freq: 138 11.525423728813559 11.525423728813559 weight: 138 0.1694915254237288 0.1694915254237288 freq: 139 11.694915254237287 11.694915254237287 weight: 139 0.1694915254237288 0.1694915254237288 freq: 140 11.864406779661017 11.864406779661017 weight: 140 0.1694915254237288 0.1694915254237288 freq: 141 12.033898305084746 12.033898305084746 weight: 141 0.1694915254237288 0.1694915254237288 freq: 142 12.203389830508474 12.203389830508474 weight: 142 0.1694915254237288 0.1694915254237288 freq: 143 12.372881355932202 12.372881355932202 weight: 143 0.1694915254237288 0.1694915254237288 freq: 144 12.54237288135593 12.54237288135593 weight: 144 0.1694915254237288 0.1694915254237288 freq: 145 12.711864406779661 12.711864406779661 weight: 145 0.1694915254237288 0.1694915254237288 freq: 146 12.88135593220339 12.88135593220339 weight: 146 0.1694915254237288 0.1694915254237288 freq: 147 13.050847457627118 13.050847457627118 weight: 147 0.1694915254237288 0.1694915254237288 freq: 148 13.220338983050848 13.220338983050848 weight: 148 0.1694915254237288 0.1694915254237288 freq: 149 13.389830508474576 13.389830508474576 weight: 149 0.1694915254237288 0.1694915254237288 freq: 150 13.559322033898304 13.559322033898304 weight: 150 0.1694915254237288 0.1694915254237288 freq: 151 13.728813559322033 13.728813559322033 weight: 151 0.1694915254237288 0.1694915254237288 freq: 152 13.898305084745761 13.898305084745761 weight: 152 0.1694915254237288 0.1694915254237288 freq: 153 14.067796610169491 14.067796610169491 weight: 153 0.1694915254237288 0.1694915254237288 freq: 154 14.23728813559322 14.23728813559322 weight: 154 0.1694915254237288 0.1694915254237288 freq: 155 14.406779661016948 14.406779661016948 weight: 155 0.1694915254237288 0.1694915254237288 freq: 156 14.576271186440678 14.576271186440678 weight: 156 0.1694915254237288 0.1694915254237288 freq: 157 14.745762711864407 14.745762711864407 weight: 157 0.1694915254237288 0.1694915254237288 freq: 158 14.915254237288135 14.915254237288135 weight: 158 0.1694915254237288 0.1694915254237288 freq: 159 15.084745762711863 15.084745762711863 weight: 159 0.1694915254237288 0.1694915254237288 freq: 160 15.254237288135592 15.254237288135592 weight: 160 0.1694915254237288 0.1694915254237288 freq: 161 15.423728813559322 15.423728813559322 weight: 161 0.1694915254237288 0.1694915254237288 freq: 162 15.59322033898305 15.59322033898305 weight: 162 0.1694915254237288 0.1694915254237288 freq: 163 15.762711864406779 15.762711864406779 weight: 163 0.1694915254237288 0.1694915254237288 freq: 164 15.932203389830509 15.932203389830509 weight: 164 0.1694915254237288 0.1694915254237288 freq: 165 16.101694915254235 16.101694915254235 weight: 165 0.1694915254237288 0.1694915254237288 freq: 166 16.271186440677965 16.271186440677965 weight: 166 0.1694915254237288 0.1694915254237288 freq: 167 16.440677966101696 16.440677966101696 weight: 167 0.1694915254237288 0.1694915254237288 freq: 168 16.610169491525422 16.610169491525422 weight: 168 0.1694915254237288 0.1694915254237288 freq: 169 16.779661016949152 16.779661016949152 weight: 169 0.1694915254237288 0.1694915254237288 freq: 170 16.94915254237288 16.94915254237288 weight: 170 0.1694915254237288 0.1694915254237288 freq: 171 17.11864406779661 17.11864406779661 weight: 171 0.1694915254237288 0.1694915254237288 freq: 172 17.28813559322034 17.28813559322034 weight: 172 0.1694915254237288 0.1694915254237288 freq: 173 17.457627118644066 17.457627118644066 weight: 173 0.1694915254237288 0.1694915254237288 freq: 174 17.627118644067796 17.627118644067796 weight: 174 0.1694915254237288 0.1694915254237288 freq: 175 17.796610169491526 17.796610169491526 weight: 175 0.1694915254237288 0.1694915254237288 freq: 176 17.966101694915253 17.966101694915253 weight: 176 0.1694915254237288 0.1694915254237288 freq: 177 18.135593220338983 18.135593220338983 weight: 177 0.1694915254237288 0.1694915254237288 freq: 178 18.305084745762713 18.305084745762713 weight: 178 0.1694915254237288 0.1694915254237288 freq: 179 18.47457627118644 18.47457627118644 weight: 179 0.1694915254237288 0.1694915254237288 freq: 180 18.64406779661017 18.64406779661017 weight: 180 0.1694915254237288 0.1694915254237288 freq: 181 18.813559322033896 18.813559322033896 weight: 181 0.1694915254237288 0.1694915254237288 freq: 182 18.983050847457626 18.983050847457626 weight: 182 0.1694915254237288 0.1694915254237288 freq: 183 19.152542372881356 19.152542372881356 weight: 183 0.1694915254237288 0.1694915254237288 freq: 184 19.322033898305083 19.322033898305083 weight: 184 0.1694915254237288 0.1694915254237288 freq: 185 19.491525423728813 19.491525423728813 weight: 185 0.1694915254237288 0.1694915254237288 freq: 186 19.66101694915254 19.66101694915254 weight: 186 0.1694915254237288 0.1694915254237288 freq: 187 19.83050847457627 19.83050847457627 weight: 187 0.1694915254237288 0.1694915254237288 freq: 188 20. 20. weight: 188 0.1694915254237288 0.1694915254237288 ENE H (4.941728591918945,0.) (4.490381717681885,0.) (4.490381717681885,0.) (4.490381717681885,0.) (0.3620595633983612,0.) Routine calculate_compact_pola_lanczos ******************************* RESTART FROM POINT 3 ******************************* Routine: do_polarization_lanczos Lanczos dimensions 137 20 Lanczos elemets: 1 20.907363870069915 12.949907557739298 Lanczos elemets: 2 20.287193006938715 12.360842701707796 Lanczos elemets: 3 17.091883124310208 12.0867681233995 Lanczos elemets: 4 17.43454160496216 12.413821574756966 Lanczos elemets: 5 17.759852374835816 12.516680849018996 Lanczos elemets: 6 22.057216540707703 12.691519047600348 Lanczos elemets: 7 22.595901263615943 12.28501503484163 Lanczos elemets: 8 23.52422086738574 12.652728873540077 Lanczos elemets: 9 28.95066902815276 10.526943565274134 Lanczos elemets: 10 22.274229278816033 11.956162549344068 Lanczos elemets: 11 22.634741999101717 12.504487506741023 Lanczos elemets: 12 18.332870093618197 11.725423454581085 Lanczos elemets: 13 16.216652129971724 10.675463962893586 Lanczos elemets: 14 15.87934183088693 10.960802967877026 Lanczos elemets: 15 16.14252463852222 10.349766558662942 Lanczos elemets: 16 15.71807154066942 10.153728161803276 Lanczos elemets: 17 15.63028638906234 10.562694747538316 Lanczos elemets: 18 15.714723666331373 10.170345312946353 Lanczos elemets: 19 14.77108747345118 10.305576076584067 Lanczos elemets: 20 13.773809858827866 10.918718764116758 Lanczos elemets: 21 17.38503184215025 11.33647636933387 Lanczos elemets: 22 14.301773379275508 13.050390356257296 Lanczos elemets: 23 19.018684662284628 12.539954835287688 Lanczos elemets: 24 19.626080029798466 12.643904683126815 Lanczos elemets: 25 17.26763399795938 12.677807969410159 Lanczos elemets: 26 14.293442493759356 11.34404783599114 Lanczos elemets: 27 15.684398199573948 11.55907451590183 Lanczos elemets: 28 19.71100634711141 13.08515199727073 Lanczos elemets: 29 14.458314034765552 12.06585602489324 Lanczos elemets: 30 14.233012374910675 11.278659114926903 Lanczos elemets: 31 15.606837151166129 12.567608458063127 Lanczos elemets: 32 19.07878569446276 12.493107416856192 Lanczos elemets: 33 19.89378569723711 12.162506364557126 Lanczos elemets: 34 19.816448447739063 13.074817129876399 Lanczos elemets: 35 25.920652947027246 11.682166183703433 Lanczos elemets: 36 17.53049122268233 11.689479581087875 Lanczos elemets: 37 21.759600401295124 12.051995848424216 Lanczos elemets: 38 17.744579948803796 11.77435754371684 Lanczos elemets: 39 15.166966627224154 10.92298913280567 Lanczos elemets: 40 15.989137727374715 10.473613771144098 Lanczos elemets: 41 21.91291106872983 12.03006811868688 Lanczos elemets: 42 12.744584657829405 9.4529275783534 Lanczos elemets: 43 14.889771106683813 10.00584934778302 Lanczos elemets: 44 12.344031239425952 9.515419838247837 Lanczos elemets: 45 16.157377276144985 11.38744859457326 Lanczos elemets: 46 12.532087056417268 10.859355118514543 Lanczos elemets: 47 11.153845677153086 9.278967337683461 Lanczos elemets: 48 13.211889319181715 10.460315465530133 Lanczos elemets: 49 12.326860847588746 9.608447692914464 Lanczos elemets: 50 9.205202179936148 9.361249971550013 Lanczos elemets: 51 15.057512592546754 10.384365839880502 Lanczos elemets: 52 9.094376295724544 7.7409486270582795 Lanczos elemets: 53 10.373767873945207 8.94973909854738 Lanczos elemets: 54 10.944509457865419 9.260900847401324 Lanczos elemets: 55 17.511322553536154 12.535044649378923 Lanczos elemets: 56 11.07238166481778 10.321242476036431 Lanczos elemets: 57 8.557607644638427 9.21351009648203 Lanczos elemets: 58 12.10416680339538 10.262821799469608 Lanczos elemets: 59 19.00776269352692 12.024755703815243 Lanczos elemets: 60 21.634478637472697 13.486916748985664 Lanczos elemets: 61 11.01708805683345 10.16316484984454 Lanczos elemets: 62 13.732658375263131 10.147452876946382 Lanczos elemets: 63 13.280081273600022 10.486035418978787 Lanczos elemets: 64 8.647098891186172 7.227440318607993 Lanczos elemets: 65 23.816253178230028 11.827724684811294 Lanczos elemets: 66 11.228756999909649 10.894410615429742 Lanczos elemets: 67 11.90595665770871 11.05534589717645 Lanczos elemets: 68 13.455340935209875 10.959867567414333 Lanczos elemets: 69 13.401832496698795 8.816186035070256 Lanczos elemets: 70 17.793001290899518 12.272710861045578 Lanczos elemets: 71 15.114068656827076 11.181794464156297 Lanczos elemets: 72 12.123567227907092 9.081772533873098 Lanczos elemets: 73 10.375010116420459 7.928311001076439 Lanczos elemets: 74 12.246653032080268 9.461147416005504 Lanczos elemets: 75 9.150828989029648 8.79457980697978 Lanczos elemets: 76 14.35555521260686 10.605210018532688 Lanczos elemets: 77 10.649160469109098 10.295389177820336 Lanczos elemets: 78 18.22876408076965 10.947148755363738 Lanczos elemets: 79 11.111770301169399 8.85330907723748 Lanczos elemets: 80 15.822470328601238 10.626711141956193 Lanczos elemets: 81 8.056554395819028 7.211591167520007 Lanczos elemets: 82 11.537418007234102 9.49630184814815 Lanczos elemets: 83 8.877583889781121 7.736017592749911 Lanczos elemets: 84 9.383363047224313 7.919153889293224 Lanczos elemets: 85 10.451547871016823 8.345829983476989 Lanczos elemets: 86 10.877595804109479 9.393284138807093 Lanczos elemets: 87 9.572551587140842 8.050260597976532 Lanczos elemets: 88 7.366624880765736 5.534458437633285 Lanczos elemets: 89 7.571511070203255 6.876761464489636 Lanczos elemets: 90 7.68066017510548 7.041425201769411 Lanczos elemets: 91 7.9932222364671865 8.602919792856792 Lanczos elemets: 92 6.5960565690246735 6.1259201273715975 Lanczos elemets: 93 6.658343393081463 6.17472158738534 Lanczos elemets: 94 7.898091855452628 6.302345514530279 Lanczos elemets: 95 8.20004891294893 6.84502888560943 Lanczos elemets: 96 8.111567104556755 6.60328970048385 Lanczos elemets: 97 7.936776160922779 5.7130979193721885 Lanczos elemets: 98 7.745548978879387 5.637474242956153 Lanczos elemets: 99 9.471367663901624 5.861500045561365 Lanczos elemets: 100 14.134631299201345 9.855754010395097 Lanczos elemets: 101 7.990001515711009 6.5752092620067835 Lanczos elemets: 102 8.042357398125262 6.51622846554139 Lanczos elemets: 103 9.674789234714503 7.135314733010562 Lanczos elemets: 104 10.562836320314204 9.340432170640689 Lanczos elemets: 105 10.666181737144083 9.353523272653778 Lanczos elemets: 106 7.798747246445137 8.638586759335677 Lanczos elemets: 107 7.543185939140186 7.7925087983547225 Lanczos elemets: 108 7.380902786325761 7.518343809672256 Lanczos elemets: 109 7.5949835565306945 8.548464189777725 Lanczos elemets: 110 13.16231452731754 9.92417876066591 Lanczos elemets: 111 12.640866318404566 9.855349400094592 Lanczos elemets: 112 12.489943123550887 9.534208904262814 Lanczos elemets: 113 11.807217161318599 9.426835359903881 Lanczos elemets: 114 9.553453818329398 8.239445596698003 Lanczos elemets: 115 9.06896291601062 7.544188049108552 Lanczos elemets: 116 7.277066885804376 4.634099836795398 Lanczos elemets: 117 9.133588033385433 7.516007182842088 Lanczos elemets: 118 6.9612605388676325 4.779738515302345 Lanczos elemets: 119 17.680841828351518 10.855349470186685 Lanczos elemets: 120 17.56399852599654 10.878357963335691 Lanczos elemets: 121 8.730008258519742 8.656210957669229 Lanczos elemets: 122 10.76179695896155 8.14409537332601 Lanczos elemets: 123 13.557670170995005 9.320434179406375 Lanczos elemets: 124 13.552865984915414 9.349367326548645 Lanczos elemets: 125 12.582801690945963 10.938453739307667 Lanczos elemets: 126 7.529375814978942 6.731322823267893 Lanczos elemets: 127 7.573450647444096 6.7798931770218065 Lanczos elemets: 128 7.6377037174495275 6.543050137382328 Lanczos elemets: 129 7.651315446824716 6.550820052587344 Lanczos elemets: 130 9.72448922529395 8.805853034996021 Lanczos elemets: 131 7.675654425120383 7.18815758460549 Lanczos elemets: 132 7.581039929749437 7.095424416648418 Lanczos elemets: 133 7.017703712049137 6.595788496229652 Lanczos elemets: 134 8.16328010706199 7.589814060809421 Lanczos elemets: 135 8.200816884232946 7.619500301508349 Lanczos elemets: 136 8.346869886895833 7.2014608337791035 Lanczos elemets: 137 7.3855764764798515 7.528035329731779 do_polarization_lanczos1 0 F do_polarization_lanczos iv 1 do_polarization_lanczos1 1 F do_polarization_lanczos iv 1 do_polarization_lanczos1 2 F do_polarization_lanczos iv 1 do_polarization_lanczos1 3 F do_polarization_lanczos iv 1 do_polarization_lanczos1 4 F do_polarization_lanczos iv 1 do_polarization_lanczos1 5 F do_polarization_lanczos iv 1 do_polarization_lanczos1 6 F do_polarization_lanczos iv 1 do_polarization_lanczos1 7 F do_polarization_lanczos iv 1 do_polarization_lanczos1 8 F do_polarization_lanczos iv 1 do_polarization_lanczos1 9 F do_polarization_lanczos iv 1 do_polarization_lanczos1 10 F do_polarization_lanczos iv 1 do_polarization_lanczos1 11 F do_polarization_lanczos iv 1 do_polarization_lanczos1 12 F do_polarization_lanczos iv 1 do_polarization_lanczos1 13 F do_polarization_lanczos iv 1 do_polarization_lanczos1 14 F do_polarization_lanczos iv 1 do_polarization_lanczos1 15 F do_polarization_lanczos iv 1 do_polarization_lanczos1 16 F do_polarization_lanczos iv 1 do_polarization_lanczos1 17 F do_polarization_lanczos iv 1 do_polarization_lanczos1 18 F do_polarization_lanczos iv 1 do_polarization_lanczos1 19 F do_polarization_lanczos iv 1 do_polarization_lanczos1 20 F do_polarization_lanczos iv 1 do_polarization_lanczos1 21 F do_polarization_lanczos iv 1 do_polarization_lanczos1 22 F do_polarization_lanczos iv 1 do_polarization_lanczos1 23 F do_polarization_lanczos iv 1 do_polarization_lanczos1 24 F do_polarization_lanczos iv 1 do_polarization_lanczos1 25 F do_polarization_lanczos iv 1 do_polarization_lanczos1 26 F do_polarization_lanczos iv 1 do_polarization_lanczos1 27 F do_polarization_lanczos iv 1 do_polarization_lanczos1 28 F do_polarization_lanczos iv 1 do_polarization_lanczos1 29 F do_polarization_lanczos iv 1 do_polarization_lanczos1 30 F do_polarization_lanczos iv 1 do_polarization_lanczos1 31 F do_polarization_lanczos iv 1 do_polarization_lanczos1 32 F do_polarization_lanczos iv 1 do_polarization_lanczos1 33 F do_polarization_lanczos iv 1 do_polarization_lanczos1 34 F do_polarization_lanczos iv 1 do_polarization_lanczos1 35 F do_polarization_lanczos iv 1 do_polarization_lanczos1 36 F do_polarization_lanczos iv 1 do_polarization_lanczos1 37 F do_polarization_lanczos iv 1 do_polarization_lanczos1 38 F do_polarization_lanczos iv 1 do_polarization_lanczos1 39 F do_polarization_lanczos iv 1 do_polarization_lanczos1 40 F do_polarization_lanczos iv 1 do_polarization_lanczos1 41 F do_polarization_lanczos iv 1 do_polarization_lanczos1 42 F do_polarization_lanczos iv 1 do_polarization_lanczos1 43 F do_polarization_lanczos iv 1 do_polarization_lanczos1 44 F do_polarization_lanczos iv 1 do_polarization_lanczos1 45 F do_polarization_lanczos iv 1 do_polarization_lanczos1 46 F do_polarization_lanczos iv 1 do_polarization_lanczos1 47 F do_polarization_lanczos iv 1 do_polarization_lanczos1 48 F do_polarization_lanczos iv 1 do_polarization_lanczos1 49 F do_polarization_lanczos iv 1 do_polarization_lanczos1 50 F do_polarization_lanczos iv 1 do_polarization_lanczos1 51 F do_polarization_lanczos iv 1 do_polarization_lanczos1 52 F do_polarization_lanczos iv 1 do_polarization_lanczos1 53 F do_polarization_lanczos iv 1 do_polarization_lanczos1 54 F do_polarization_lanczos iv 1 do_polarization_lanczos1 55 F do_polarization_lanczos iv 1 do_polarization_lanczos1 56 F do_polarization_lanczos iv 1 do_polarization_lanczos1 57 F do_polarization_lanczos iv 1 do_polarization_lanczos1 58 F do_polarization_lanczos iv 1 do_polarization_lanczos1 59 F do_polarization_lanczos iv 1 do_polarization_lanczos1 60 F do_polarization_lanczos iv 1 do_polarization_lanczos1 61 F do_polarization_lanczos iv 1 do_polarization_lanczos1 62 F do_polarization_lanczos iv 1 do_polarization_lanczos1 63 F do_polarization_lanczos iv 1 do_polarization_lanczos1 64 F do_polarization_lanczos iv 1 do_polarization_lanczos1 65 F do_polarization_lanczos iv 1 do_polarization_lanczos1 66 F do_polarization_lanczos iv 1 do_polarization_lanczos1 67 F do_polarization_lanczos iv 1 do_polarization_lanczos1 68 F do_polarization_lanczos iv 1 do_polarization_lanczos1 69 F do_polarization_lanczos iv 1 do_polarization_lanczos1 70 F do_polarization_lanczos iv 1 do_polarization_lanczos1 71 F do_polarization_lanczos iv 1 do_polarization_lanczos1 72 F do_polarization_lanczos iv 1 do_polarization_lanczos1 73 F do_polarization_lanczos iv 1 do_polarization_lanczos1 74 F do_polarization_lanczos iv 1 do_polarization_lanczos1 75 F do_polarization_lanczos iv 1 do_polarization_lanczos1 76 F do_polarization_lanczos iv 1 do_polarization_lanczos1 77 F do_polarization_lanczos iv 1 do_polarization_lanczos1 78 F do_polarization_lanczos iv 1 do_polarization_lanczos1 79 F do_polarization_lanczos iv 1 do_polarization_lanczos1 80 F do_polarization_lanczos iv 1 do_polarization_lanczos1 81 F do_polarization_lanczos iv 1 do_polarization_lanczos1 82 F do_polarization_lanczos iv 1 do_polarization_lanczos1 83 F do_polarization_lanczos iv 1 do_polarization_lanczos1 84 F do_polarization_lanczos iv 1 do_polarization_lanczos1 85 F do_polarization_lanczos iv 1 do_polarization_lanczos1 86 F do_polarization_lanczos iv 1 do_polarization_lanczos1 87 F do_polarization_lanczos iv 1 do_polarization_lanczos1 88 F do_polarization_lanczos iv 1 do_polarization_lanczos1 89 F do_polarization_lanczos iv 1 do_polarization_lanczos1 90 F do_polarization_lanczos iv 1 do_polarization_lanczos1 91 F do_polarization_lanczos iv 1 do_polarization_lanczos1 92 F do_polarization_lanczos iv 1 do_polarization_lanczos1 93 F do_polarization_lanczos iv 1 do_polarization_lanczos1 94 F do_polarization_lanczos iv 1 Call go_dressed_w 0 Read polaw 50 call calculate_w 0 1 Read polaw 50 call calculate_w 1 2 Read polaw 50 call calculate_w 2 3 Read polaw 50 call calculate_w 3 4 Read polaw 50 call calculate_w 4 5 Read polaw 50 call calculate_w 5 6 Read polaw 50 call calculate_w 6 7 Read polaw 50 call calculate_w 7 8 Read polaw 50 call calculate_w 8 9 Read polaw 50 call calculate_w 9 10 Read polaw 50 call calculate_w 10 11 Read polaw 50 call calculate_w 11 12 Read polaw 50 call calculate_w 12 13 Read polaw 50 call calculate_w 13 14 Read polaw 50 call calculate_w 14 15 Read polaw 50 call calculate_w 15 16 Read polaw 50 call calculate_w 16 17 Read polaw 50 call calculate_w 17 18 Read polaw 50 call calculate_w 18 19 Read polaw 50 call calculate_w 19 20 Read polaw 50 call calculate_w 20 21 Read polaw 50 call calculate_w 21 22 Read polaw 50 call calculate_w 22 23 Read polaw 50 call calculate_w 23 24 Read polaw 50 call calculate_w 24 25 Read polaw 50 call calculate_w 25 26 Read polaw 50 call calculate_w 26 27 Read polaw 50 call calculate_w 27 28 Read polaw 50 call calculate_w 28 29 Read polaw 50 call calculate_w 29 30 Read polaw 50 call calculate_w 30 31 Read polaw 50 call calculate_w 31 32 Read polaw 50 call calculate_w 32 33 Read polaw 50 call calculate_w 33 34 Read polaw 50 call calculate_w 34 35 Read polaw 50 call calculate_w 35 36 Read polaw 50 call calculate_w 36 37 Read polaw 50 call calculate_w 37 38 Read polaw 50 call calculate_w 38 39 Read polaw 50 call calculate_w 39 40 Read polaw 50 call calculate_w 40 41 Read polaw 50 call calculate_w 41 42 Read polaw 50 call calculate_w 42 43 Read polaw 50 call calculate_w 43 44 Read polaw 50 call calculate_w 44 45 Read polaw 50 call calculate_w 45 46 Read polaw 50 call calculate_w 46 47 Read polaw 50 call calculate_w 47 48 Read polaw 50 call calculate_w 48 49 Read polaw 50 call calculate_w 49 50 Read polaw 50 call calculate_w 50 51 Read polaw 50 call calculate_w 51 52 Read polaw 50 call calculate_w 52 53 Read polaw 50 call calculate_w 53 54 Read polaw 50 call calculate_w 54 55 Read polaw 50 call calculate_w 55 56 Read polaw 50 call calculate_w 56 57 Read polaw 50 call calculate_w 57 58 Read polaw 50 call calculate_w 58 59 Read polaw 50 call calculate_w 59 60 Read polaw 50 call calculate_w 60 61 Read polaw 50 call calculate_w 61 62 Read polaw 50 call calculate_w 62 63 Read polaw 50 call calculate_w 63 64 Read polaw 50 call calculate_w 64 65 Read polaw 50 call calculate_w 65 66 Read polaw 50 call calculate_w 66 67 Read polaw 50 call calculate_w 67 68 Read polaw 50 call calculate_w 68 69 Read polaw 50 call calculate_w 69 70 Read polaw 50 call calculate_w 70 71 Read polaw 50 call calculate_w 71 72 Read polaw 50 call calculate_w 72 73 Read polaw 50 call calculate_w 73 74 Read polaw 50 call calculate_w 74 75 Read polaw 50 call calculate_w 75 76 Read polaw 50 call calculate_w 76 77 Read polaw 50 call calculate_w 77 78 Read polaw 50 call calculate_w 78 79 Read polaw 50 call calculate_w 79 80 Read polaw 50 call calculate_w 80 81 Read polaw 50 call calculate_w 81 82 Read polaw 50 call calculate_w 82 83 Read polaw 50 call calculate_w 83 84 Read polaw 50 call calculate_w 84 85 Read polaw 50 call calculate_w 85 86 Read polaw 50 call calculate_w 86 87 Read polaw 50 call calculate_w 87 88 Read polaw 50 call calculate_w 88 89 Read polaw 50 call calculate_w 89 90 Read polaw 50 call calculate_w 90 91 Read polaw 50 call calculate_w 91 92 Read polaw 50 call calculate_w 92 93 Read polaw 50 call calculate_w 93 94 Read polaw 50 call calculate_w 94 Trasform W to Pgreek Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Done ******************************* RESTART FROM POINT 6 ******************************* Routine do_self_lanczos_time Lanczos dimensions 221 40 1 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Read polaw 50 Fourier trasform Pgreek Loop on KS: 1 1 Fourier trasform: Products in imaginary time: Loop on KS: 2 1 Fourier trasform: Products in imaginary time: Loop on KS: 3 1 Fourier trasform: Products in imaginary time: Loop on KS: 4 1 Fourier trasform: Products in imaginary time: Loop on KS: 5 1 Fourier trasform: Products in imaginary time: Call fit_multipole a_0 (0.,0.) a (0.009999999776482582,0.) (0.019999999552965164,0.) b (-0.5,-0.009999999776482582) (1.,-0.009999999776482582) z,s (0.,0.1666666716337204) (0.06201261203518993,-0.019358232853363442) (-0.001614434534243439,-0.009708741989780289) z,s (0.,10.083333015441895) (-0.017403115113758902,-0.12130505055114546) (-0.0001454505572673048,-0.0029505723811431095) Grad a_0 (0.42212830439640675,15.75890010204806) Grad a (-4.7240446099784705,0.37072725519254884) Grad a (-2.894893556572477,-1.591789037987592) Routine fit_multipole: chi1 > chi0 Routine fit_multipole: chi1 > chi0 Routine fit_multipole: maxiter reached 0.022902876087925822 Done Calling minpack Allocated Chi0 initial: 0.022902876087925822 INFO : 2 0.00001 Minpack fit chi0 : 0.0004839932121600569 Done FIT state : 1 1 FIT a_0: (-0.09288899720899862,-0.028538473925736118) FIT a: 1 (0.263269587293915,0.34131812005221596) FIT b: 1 (-1.7015349296735673,-0.6001007104902382) FIT a: 2 (0.27344992246674077,0.9171764536472236) FIT b: 2 (8.464873179474091,1.973363718387238) Call fit_multipole a_0 (0.,0.) a (0.009999999776482582,0.) (0.019999999552965164,0.) b (-0.5,-0.009999999776482582) (1.,-0.009999999776482582) z,s (0.,0.1666666716337204) (-0.02598523054010976,-0.016912101890800897) (-0.001614434534243439,-0.009708741989780289) z,s (0.,10.083333015441895) (-0.030555818679513642,-0.10878047266287035) (-0.0001454505572673048,-0.0029505723811431095) Grad a_0 (4.986104075655374,13.685420083134032) Grad a (-2.9853919361983814,2.2080477056014995) Grad a (-3.5410611991150907,-0.007211466326349645) Routine fit_multipole: chi1 > chi0 Routine fit_multipole: chi1 > chi0 Routine fit_multipole: maxiter reached 0.009380048601146562 Done Calling minpack Allocated Chi0 initial: 0.009380048601146562 INFO : 2 0.00001 Minpack fit chi0 : 0.00011066951271443083 Done FIT state : 2 1 FIT a_0: (-0.02964366267009599,-0.022391882073973045) FIT a: 1 (0.2664068714155019,0.19790598091600523) FIT b: 1 (-1.9363015747480223,-0.5374129617525306) FIT a: 2 (0.8418344697783462,0.0752408023092941) FIT b: 2 (5.271466238585698,-0.7306082622750365) Call fit_multipole a_0 (0.,0.) a (0.009999999776482582,0.) (0.019999999552965164,0.) b (-0.5,-0.009999999776482582) (1.,-0.009999999776482582) z,s (0.,0.1666666716337204) (-0.025788951179370998,-0.016912286443600124) (-0.001614434534243439,-0.009708741989780289) z,s (0.,10.083333015441895) (-0.030551560509771064,-0.10884497960060154) (-0.0001454505572673048,-0.0029505723811431095) Grad a_0 (4.973793067756555,13.693351360933985) Grad a (-2.989834108742432,2.202967741972011) Grad a (-3.539685735383135,-0.011404668437788746) Routine fit_multipole: chi1 > chi0 Routine fit_multipole: chi1 > chi0 Routine fit_multipole: maxiter reached 0.009448376384917882 Done Calling minpack Allocated Chi0 initial: 0.009448376384917882 INFO : 2 0.00001 Minpack fit chi0 : 0.0001114190522474182 Done FIT state : 3 1 FIT a_0: (-0.030066939589541465,-0.022218564519984847) FIT a: 1 (0.2660397407666428,0.20014392526473693) FIT b: 1 (-1.9338061737216592,-0.5429387167335262) FIT a: 2 (0.8441972916492649,0.08080166715740619) FIT b: 2 (5.291111229286791,-0.7282795519117303) Out of create_self_energy_fit value, zeta: 1 (0.2603357768906899,-0.0035797105327476375) (-0.39164748617630535,-0.12432863212831273) 1 XC-DFT energy 1 -1.05178768928371 H-DFT energy 1 67.23563581947754 (67.23563682451967,0.) GW-PERT energy 1 -20.29571793724957 Iteration energy 1 (0.39000739935284584,0.05224788833315441) Iteration energy 2 (0.3904874096447489,0.027577263390217932) Iteration energy 3 (0.381146695430141,0.04080171768138395) Iteration energy 4 (0.39113202703278743,0.03724190261147094) Iteration energy 5 (0.3843754020808459,0.03543000784186179) Iteration energy 6 (0.3873355095550119,0.03892681428110023) Iteration energy 7 (0.38705154878235626,0.03592529274545242) Iteration energy 8 (0.3860830080125533,0.03765253803501825) Iteration energy 9 (0.3872529601138659,0.037084268194369455) Iteration energy 10 (0.38640810925902225,0.03695291611926836) value, zeta: 2 (0.00830807851544274,-0.0058895044063597204) (-0.13866529136521433,0.009014659675616469) 1 XC-DFT energy 2 -0.9868812482661686 H-DFT energy 2 61.094752506545284 (61.094750299972375,0.) GW-PERT energy 2 -13.676141120095094 Iteration energy 1 (0.06269360397555693,-0.0036508464012795783) Iteration energy 2 (0.0612941000078476,-0.0045889136051467765) Iteration energy 3 (0.06154195844380733,-0.00438626885728316) Iteration energy 4 (0.0614987321576872,-0.004429114468477317) Iteration energy 5 (0.061506135414464924,-0.0044202237826828535) Iteration energy 6 (0.06150489564864786,-0.004422040319321689) Iteration energy 7 (0.06150509732553194,-0.004421674113164773) Iteration energy 8 (0.06150506579949819,-0.00442174706432721) Iteration energy 9 (0.06150507044299691,-0.0044217326886358994) Iteration energy 10 (0.06150506982484977,-0.004421735493062191) value, zeta: 3 (0.00855955247185164,-0.005950476662868694) (-0.13897909279940454,0.008982199931304965) 1 XC-DFT energy 3 -0.9868812482919485 H-DFT energy 3 61.094752508792766 (61.094750299972375,0.) GW-PERT energy 3 -13.671878371566612 Iteration energy 1 (0.06300482050943487,-0.0036369529025886277) Iteration energy 2 (0.061605916112590836,-0.004589599850658682) Iteration energy 3 (0.06185348010688965,-0.004383339759896628) Iteration energy 4 (0.06181037647169674,-0.004427030363018818) Iteration energy 5 (0.061817737911059184,-0.004417950530098597) Iteration energy 6 (0.06181651069586122,-0.004419808005620144) Iteration energy 7 (0.061816708917308894,-0.0044194331832398785) Iteration energy 8 (0.06181667828578932,-0.0044195079038584426) Iteration energy 9 (0.06181668270820176,-0.004419493172889491) Iteration energy 10 (0.06181668214275193,-0.004419496047120403) value, zeta: 4 (0.008434028415909789,-0.005562055019555007) (-0.1382412033130415,0.007523323284176027) 1 XC-DFT energy 4 -0.9868812482757066 H-DFT energy 4 61.094752507441406 (61.094750299972375,0.) GW-PERT energy 4 -13.676540940060042 Iteration energy 1 (0.06239537889821381,-0.0028891600166354205) Iteration energy 2 (0.06107210819749667,-0.0038328613320268434) Iteration energy 3 (0.06130081141019672,-0.0036302840370568724) Iteration energy 4 (0.061262080659204965,-0.0036727187015638194) Iteration energy 5 (0.061268478678930094,-0.0036640138890629732) Iteration energy 6 (0.06126745552513907,-0.003665768820878105) Iteration energy 7 (0.06126761192784083,-0.003665420325284219) Iteration energy 8 (0.061267589615652845,-0.003665488599326472) Iteration energy 9 (0.06126759242951105,-0.0036654753893873224) Iteration energy 10 (0.061267592166146356,-0.0036654779153976746) value, zeta: 5 (-0.048553927740493115,0.0020557367998662555) (-0.03315667638913444,-0.0032532249148312367) 1 XC-DFT energy 5 -0.15405669376161996 H-DFT energy 5 4.9260709082213605 (4.926070879996165,0.) GW-PERT energy 5 0.2141228571881689 Iteration energy 1 (-0.05048827544842557,0.0017230661319912778) Iteration energy 2 (-0.050487394023903495,0.001726315431475424) Iteration energy 3 (-0.05048740413080222,0.0017261973354713127) Iteration energy 4 (-0.050487404523075735,0.0017262014898243479) Iteration energy 5 (-0.05048740448337241,0.0017262013483843805) Iteration energy 6 (-0.05048740448563684,0.0017262013530342478) Iteration energy 7 (-0.05048740448552917,0.0017262013528874139) Iteration energy 8 (-0.050487404485533835,0.0017262013528918235) Iteration energy 9 (-0.05048740448553364,0.0017262013528916952) Iteration energy 10 (-0.05048740448553365,0.0017262013528917056) QUASI-PARTICLES ENERGIES IN Ev, Spin: 1 1 State: 1DFT : -16.61246 GW-PERT : -20.29572 GW : -20.05952 HF-pert : -25.31687 State: 2DFT : -9.11161 GW-PERT : -13.67614 GW : -13.58626 HF-pert : -14.42308 State: 3DFT : -9.11161 GW-PERT : -13.67188 GW : -13.58202 HF-pert : -14.42308 State: 4DFT : -9.11161 GW-PERT : -13.67654 GW : -13.58949 HF-pert : -14.42308 State: 5DFT : -0.56517 GW-PERT : 0.21412 GW : 0.21358 HF-pert : 0.90049 IMAGINARY ENERGIES IN Ev: State: 1 GW (Im) : 0.50277 State: 2 GW (Im) : -0.06016 State: 3 GW (Im) : -0.06013 State: 4 GW (Im) : -0.04987 State: 5 GW (Im) : 0.02349 Stopping MPI environment