Program turboTDDFT v.6.0 (svn rev. 13233) starts on 10Jan2017 at 14: 4:53 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 1 processors Reading data from directory: ./out/CH4.save Info: using nr1, nr2, nr3 values from input Info: using nr1, nr2, nr3 values from input IMPORTANT: XC functional enforced from input : Exchange-correlation = SLA PZ NOGX NOGC ( 1 1 0 0 0 0) Any further DFT definition will be discarded Please, verify this is what you really want file H.pz-vbc.UPF: wavefunction(s) 1S renormalized G-vector sticks info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Sum 7153 7153 1789 455863 455863 57051 Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used =-----------------------------------------------------------------= Please cite the TDDFPT project as: O. B. Malcioglu, R. Gebauer, D. Rocca, and S. Baroni, Comput. Phys. Commun. 182, 1744 (2011) and X. Ge, S. J. Binnie, D. Rocca, R. Gebauer, and S. Baroni, Comput. Phys. Commun. 185, 2080 (2014) in publications and presentations arising from this work. =-----------------------------------------------------------------= Normal read Gamma point algorithm LANCZOS LINEAR-RESPONSE SPECTRUM CALCULATION Number of Lanczos iterations = 200 Starting Lanczos loop 1 Lanczos iteration: 1 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000001)= 0.000000 beta (00000001)= 1.985919 gamma(00000001)= 1.985919 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 2 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000002)= 0.000000 beta (00000002)= 2.687605 gamma(00000002)= 2.687605 z1= 1 0.738917499510826E+00 0.000000000000000E+00 Lanczos iteration: 3 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000003)= 0.000000 beta (00000003)= 9.321383 gamma(00000003)= 9.321383 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 4 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000004)= 0.000000 beta (00000004)= 14.407582 gamma(00000004)= 14.407582 z1= 1 -0.478063064143732E+00 0.000000000000000E+00 Lanczos iteration: 5 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000005)= 0.000000 beta (00000005)= 12.161297 gamma(00000005)= 12.161297 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 6 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000006)= 0.000000 beta (00000006)= 13.978091 gamma(00000006)= 13.978091 z1= 1 0.415927088372793E+00 0.000000000000000E+00 Lanczos iteration: 7 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000007)= 0.000000 beta (00000007)= 12.487760 gamma(00000007)= 12.487760 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 8 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000008)= 0.000000 beta (00000008)= 13.652789 gamma(00000008)= 13.652789 z1= 1 -0.380434915734428E+00 0.000000000000000E+00 Lanczos iteration: 9 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000009)= 0.000000 beta (00000009)= 12.678679 gamma(00000009)= 12.678679 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 10 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000010)= 0.000000 beta (00000010)= 13.531106 gamma(00000010)= 13.531106 z1= 1 0.356468438747052E+00 0.000000000000000E+00 Lanczos iteration: 11 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000011)= 0.000000 beta (00000011)= 12.766869 gamma(00000011)= 12.766869 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 12 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000012)= 0.000000 beta (00000012)= 13.512871 gamma(00000012)= 13.512871 z1= 1 -0.336788968809084E+00 0.000000000000000E+00 Lanczos iteration: 13 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000013)= 0.000000 beta (00000013)= 12.783646 gamma(00000013)= 12.783646 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 14 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000014)= 0.000000 beta (00000014)= 13.518564 gamma(00000014)= 13.518564 z1= 1 0.318479898257901E+00 0.000000000000000E+00 Lanczos iteration: 15 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000015)= 0.000000 beta (00000015)= 12.764479 gamma(00000015)= 12.764479 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 16 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000016)= 0.000000 beta (00000016)= 13.501488 gamma(00000016)= 13.501488 z1= 1 -0.301094958436096E+00 0.000000000000000E+00 Lanczos iteration: 17 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000017)= 0.000000 beta (00000017)= 12.736310 gamma(00000017)= 12.736310 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 18 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000018)= 0.000000 beta (00000018)= 13.471373 gamma(00000018)= 13.471373 z1= 1 0.284665756902631E+00 0.000000000000000E+00 Lanczos iteration: 19 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000019)= 0.000000 beta (00000019)= 12.731717 gamma(00000019)= 12.731717 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 20 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000020)= 0.000000 beta (00000020)= 13.460816 gamma(00000020)= 13.460816 z1= 1 -0.269246970168373E+00 0.000000000000000E+00 Lanczos iteration: 21 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000021)= 0.000000 beta (00000021)= 12.758899 gamma(00000021)= 12.758899 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 22 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000022)= 0.000000 beta (00000022)= 13.465819 gamma(00000022)= 13.465819 z1= 1 0.255112220726852E+00 0.000000000000000E+00 Lanczos iteration: 23 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000023)= 0.000000 beta (00000023)= 12.788015 gamma(00000023)= 12.788015 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 24 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000024)= 0.000000 beta (00000024)= 13.467978 gamma(00000024)= 13.467978 z1= 1 -0.242232285368375E+00 0.000000000000000E+00 Lanczos iteration: 25 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000025)= 0.000000 beta (00000025)= 12.807912 gamma(00000025)= 12.807912 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 26 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000026)= 0.000000 beta (00000026)= 13.459850 gamma(00000026)= 13.459850 z1= 1 0.230499573810379E+00 0.000000000000000E+00 Lanczos iteration: 27 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000027)= 0.000000 beta (00000027)= 12.791237 gamma(00000027)= 12.791237 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 28 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000028)= 0.000000 beta (00000028)= 13.416117 gamma(00000028)= 13.416117 z1= 1 -0.219763642475186E+00 0.000000000000000E+00 Lanczos iteration: 29 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000029)= 0.000000 beta (00000029)= 12.772136 gamma(00000029)= 12.772136 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 30 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000030)= 0.000000 beta (00000030)= 13.434637 gamma(00000030)= 13.434637 z1= 1 0.208926461456051E+00 0.000000000000000E+00 Lanczos iteration: 31 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000031)= 0.000000 beta (00000031)= 12.808926 gamma(00000031)= 12.808926 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 32 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000032)= 0.000000 beta (00000032)= 13.418606 gamma(00000032)= 13.418606 z1= 1 -0.199433789733760E+00 0.000000000000000E+00 Lanczos iteration: 33 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000033)= 0.000000 beta (00000033)= 12.740657 gamma(00000033)= 12.740657 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 34 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000034)= 0.000000 beta (00000034)= 13.378160 gamma(00000034)= 13.378160 z1= 1 0.189930278765764E+00 0.000000000000000E+00 Lanczos iteration: 35 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000035)= 0.000000 beta (00000035)= 12.788279 gamma(00000035)= 12.788279 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 36 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000036)= 0.000000 beta (00000036)= 13.442102 gamma(00000036)= 13.442102 z1= 1 -0.180692090873971E+00 0.000000000000000E+00 Lanczos iteration: 37 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000037)= 0.000000 beta (00000037)= 12.782584 gamma(00000037)= 12.782584 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 38 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000038)= 0.000000 beta (00000038)= 13.387138 gamma(00000038)= 13.387138 z1= 1 0.172532157276393E+00 0.000000000000000E+00 Lanczos iteration: 39 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000039)= 0.000000 beta (00000039)= 12.737312 gamma(00000039)= 12.737312 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 40 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000040)= 0.000000 beta (00000040)= 13.333456 gamma(00000040)= 13.333456 z1= 1 -0.164818169396649E+00 0.000000000000000E+00 Lanczos iteration: 41 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000041)= 0.000000 beta (00000041)= 12.689640 gamma(00000041)= 12.689640 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 42 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000042)= 0.000000 beta (00000042)= 13.357610 gamma(00000042)= 13.357610 z1= 1 0.156576157718806E+00 0.000000000000000E+00 Lanczos iteration: 43 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000043)= 0.000000 beta (00000043)= 12.751961 gamma(00000043)= 12.751961 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 44 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000044)= 0.000000 beta (00000044)= 13.375440 gamma(00000044)= 13.375440 z1= 1 -0.149277556387439E+00 0.000000000000000E+00 Lanczos iteration: 45 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000045)= 0.000000 beta (00000045)= 12.776255 gamma(00000045)= 12.776255 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 46 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000046)= 0.000000 beta (00000046)= 13.408426 gamma(00000046)= 13.408426 z1= 1 0.142239522399042E+00 0.000000000000000E+00 Lanczos iteration: 47 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000047)= 0.000000 beta (00000047)= 12.735755 gamma(00000047)= 12.735755 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 48 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000048)= 0.000000 beta (00000048)= 13.409555 gamma(00000048)= 13.409555 z1= 1 -0.135092305540742E+00 0.000000000000000E+00 Lanczos iteration: 49 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000049)= 0.000000 beta (00000049)= 12.852003 gamma(00000049)= 12.852003 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 50 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000050)= 0.000000 beta (00000050)= 13.372039 gamma(00000050)= 13.372039 z1= 1 0.129838594086191E+00 0.000000000000000E+00 Lanczos iteration: 51 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000051)= 0.000000 beta (00000051)= 12.661146 gamma(00000051)= 12.661146 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 52 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000052)= 0.000000 beta (00000052)= 13.332123 gamma(00000052)= 13.332123 z1= 1 -0.123304101384984E+00 0.000000000000000E+00 Lanczos iteration: 53 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000053)= 0.000000 beta (00000053)= 12.722819 gamma(00000053)= 12.722819 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 54 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000054)= 0.000000 beta (00000054)= 13.331134 gamma(00000054)= 13.331134 z1= 1 0.117677599563210E+00 0.000000000000000E+00 Lanczos iteration: 55 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000055)= 0.000000 beta (00000055)= 12.758280 gamma(00000055)= 12.758280 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 56 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000056)= 0.000000 beta (00000056)= 13.406041 gamma(00000056)= 13.406041 z1= 1 -0.111991580104229E+00 0.000000000000000E+00 Lanczos iteration: 57 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000057)= 0.000000 beta (00000057)= 12.847355 gamma(00000057)= 12.847355 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 58 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000058)= 0.000000 beta (00000058)= 13.403910 gamma(00000058)= 13.403910 z1= 1 0.107341486202158E+00 0.000000000000000E+00 Lanczos iteration: 59 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000059)= 0.000000 beta (00000059)= 12.708513 gamma(00000059)= 12.708513 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 60 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000060)= 0.000000 beta (00000060)= 13.405991 gamma(00000060)= 13.405991 z1= 1 -0.101756800797855E+00 0.000000000000000E+00 Lanczos iteration: 61 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000061)= 0.000000 beta (00000061)= 12.811418 gamma(00000061)= 12.811418 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 62 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000062)= 0.000000 beta (00000062)= 13.396233 gamma(00000062)= 13.396233 z1= 1 0.973145865550629E-01 0.000000000000000E+00 Lanczos iteration: 63 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000063)= 0.000000 beta (00000063)= 12.867919 gamma(00000063)= 12.867919 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 64 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000064)= 0.000000 beta (00000064)= 13.420562 gamma(00000064)= 13.420562 z1= 1 -0.933072841544093E-01 0.000000000000000E+00 Lanczos iteration: 65 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000065)= 0.000000 beta (00000065)= 12.851935 gamma(00000065)= 12.851935 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 66 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000066)= 0.000000 beta (00000066)= 13.489529 gamma(00000066)= 13.489529 z1= 1 0.888970337640164E-01 0.000000000000000E+00 Lanczos iteration: 67 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000067)= 0.000000 beta (00000067)= 12.807235 gamma(00000067)= 12.807235 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 68 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000068)= 0.000000 beta (00000068)= 13.405776 gamma(00000068)= 13.405776 z1= 1 -0.849279598291200E-01 0.000000000000000E+00 Lanczos iteration: 69 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000069)= 0.000000 beta (00000069)= 12.783436 gamma(00000069)= 12.783436 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 70 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000070)= 0.000000 beta (00000070)= 13.362485 gamma(00000070)= 13.362485 z1= 1 0.812476938127137E-01 0.000000000000000E+00 Lanczos iteration: 71 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000071)= 0.000000 beta (00000071)= 12.814199 gamma(00000071)= 12.814199 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 72 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000072)= 0.000000 beta (00000072)= 13.433636 gamma(00000072)= 13.433636 z1= 1 -0.775012857536456E-01 0.000000000000000E+00 Lanczos iteration: 73 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000073)= 0.000000 beta (00000073)= 12.817155 gamma(00000073)= 12.817155 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 74 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000074)= 0.000000 beta (00000074)= 13.276626 gamma(00000074)= 13.276626 z1= 1 0.748191572840363E-01 0.000000000000000E+00 Lanczos iteration: 75 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000075)= 0.000000 beta (00000075)= 12.770736 gamma(00000075)= 12.770736 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 76 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000076)= 0.000000 beta (00000076)= 13.375875 gamma(00000076)= 13.375875 z1= 1 -0.714342561681716E-01 0.000000000000000E+00 Lanczos iteration: 77 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000077)= 0.000000 beta (00000077)= 12.758988 gamma(00000077)= 12.758988 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 78 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000078)= 0.000000 beta (00000078)= 13.416389 gamma(00000078)= 13.416389 z1= 1 0.679339927864220E-01 0.000000000000000E+00 Lanczos iteration: 79 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000079)= 0.000000 beta (00000079)= 12.777070 gamma(00000079)= 12.777070 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 80 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000080)= 0.000000 beta (00000080)= 13.342738 gamma(00000080)= 13.342738 z1= 1 -0.650539170746548E-01 0.000000000000000E+00 Lanczos iteration: 81 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000081)= 0.000000 beta (00000081)= 12.809556 gamma(00000081)= 12.809556 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 82 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000082)= 0.000000 beta (00000082)= 13.413480 gamma(00000082)= 13.413480 z1= 1 0.621249509073480E-01 0.000000000000000E+00 Lanczos iteration: 83 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000083)= 0.000000 beta (00000083)= 12.817139 gamma(00000083)= 12.817139 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 84 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000084)= 0.000000 beta (00000084)= 13.374825 gamma(00000084)= 13.374825 z1= 1 -0.595345449523133E-01 0.000000000000000E+00 Lanczos iteration: 85 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000085)= 0.000000 beta (00000085)= 12.786993 gamma(00000085)= 12.786993 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 86 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000086)= 0.000000 beta (00000086)= 13.311274 gamma(00000086)= 13.311274 z1= 1 0.571897041991905E-01 0.000000000000000E+00 Lanczos iteration: 87 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000087)= 0.000000 beta (00000087)= 12.754660 gamma(00000087)= 12.754660 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 88 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000088)= 0.000000 beta (00000088)= 13.407424 gamma(00000088)= 13.407424 z1= 1 -0.544053244682876E-01 0.000000000000000E+00 Lanczos iteration: 89 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000089)= 0.000000 beta (00000089)= 12.899623 gamma(00000089)= 12.899623 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 90 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000090)= 0.000000 beta (00000090)= 13.284695 gamma(00000090)= 13.284695 z1= 1 0.528283231392450E-01 0.000000000000000E+00 Lanczos iteration: 91 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000091)= 0.000000 beta (00000091)= 12.706868 gamma(00000091)= 12.706868 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 92 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000092)= 0.000000 beta (00000092)= 13.371965 gamma(00000092)= 13.371965 z1= 1 -0.502007410897155E-01 0.000000000000000E+00 Lanczos iteration: 93 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000093)= 0.000000 beta (00000093)= 12.771714 gamma(00000093)= 12.771714 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 94 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000094)= 0.000000 beta (00000094)= 13.350896 gamma(00000094)= 13.350896 z1= 1 0.480229575373105E-01 0.000000000000000E+00 Lanczos iteration: 95 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000095)= 0.000000 beta (00000095)= 12.805203 gamma(00000095)= 12.805203 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 96 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000096)= 0.000000 beta (00000096)= 13.382100 gamma(00000096)= 13.382100 z1= 1 -0.459527088404032E-01 0.000000000000000E+00 Lanczos iteration: 97 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000097)= 0.000000 beta (00000097)= 12.818579 gamma(00000097)= 12.818579 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 98 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000098)= 0.000000 beta (00000098)= 13.524322 gamma(00000098)= 13.524322 z1= 1 0.435547481219954E-01 0.000000000000000E+00 Lanczos iteration: 99 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000099)= 0.000000 beta (00000099)= 13.059908 gamma(00000099)= 13.059908 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 100 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000100)= 0.000000 beta (00000100)= 13.508630 gamma(00000100)= 13.508630 z1= 1 -0.421079713573946E-01 0.000000000000000E+00 Lanczos iteration: 101 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000101)= 0.000000 beta (00000101)= 12.695458 gamma(00000101)= 12.695458 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 102 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000102)= 0.000000 beta (00000102)= 13.388771 gamma(00000102)= 13.388771 z1= 1 0.399274895815494E-01 0.000000000000000E+00 Lanczos iteration: 103 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000103)= 0.000000 beta (00000103)= 12.870598 gamma(00000103)= 12.870598 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 104 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000104)= 0.000000 beta (00000104)= 13.432419 gamma(00000104)= 13.432419 z1= 1 -0.382574909164061E-01 0.000000000000000E+00 Lanczos iteration: 105 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000105)= 0.000000 beta (00000105)= 12.810449 gamma(00000105)= 12.810449 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 106 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000106)= 0.000000 beta (00000106)= 13.221967 gamma(00000106)= 13.221967 z1= 1 0.370667719065905E-01 0.000000000000000E+00 Lanczos iteration: 107 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000107)= 0.000000 beta (00000107)= 12.739932 gamma(00000107)= 12.739932 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 108 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000108)= 0.000000 beta (00000108)= 13.374106 gamma(00000108)= 13.374106 z1= 1 -0.353091370077832E-01 0.000000000000000E+00 Lanczos iteration: 109 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000109)= 0.000000 beta (00000109)= 12.840305 gamma(00000109)= 12.840305 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 110 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000110)= 0.000000 beta (00000110)= 13.236894 gamma(00000110)= 13.236894 z1= 1 0.342512444600422E-01 0.000000000000000E+00 Lanczos iteration: 111 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000111)= 0.000000 beta (00000111)= 12.833848 gamma(00000111)= 12.833848 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 112 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000112)= 0.000000 beta (00000112)= 13.564474 gamma(00000112)= 13.564474 z1= 1 -0.324063626676332E-01 0.000000000000000E+00 Lanczos iteration: 113 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000113)= 0.000000 beta (00000113)= 12.946616 gamma(00000113)= 12.946616 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 114 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000114)= 0.000000 beta (00000114)= 13.308416 gamma(00000114)= 13.308416 z1= 1 0.315253693258521E-01 0.000000000000000E+00 Lanczos iteration: 115 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000115)= 0.000000 beta (00000115)= 12.823355 gamma(00000115)= 12.823355 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 116 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000116)= 0.000000 beta (00000116)= 13.444017 gamma(00000116)= 13.444017 z1= 1 -0.300699572075104E-01 0.000000000000000E+00 Lanczos iteration: 117 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000117)= 0.000000 beta (00000117)= 12.620704 gamma(00000117)= 12.620704 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 118 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000118)= 0.000000 beta (00000118)= 13.335835 gamma(00000118)= 13.335835 z1= 1 0.284574628280142E-01 0.000000000000000E+00 Lanczos iteration: 119 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000119)= 0.000000 beta (00000119)= 12.790259 gamma(00000119)= 12.790259 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 120 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000120)= 0.000000 beta (00000120)= 13.202717 gamma(00000120)= 13.202717 z1= 1 -0.275684422458134E-01 0.000000000000000E+00 Lanczos iteration: 121 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000121)= 0.000000 beta (00000121)= 12.533206 gamma(00000121)= 12.533206 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 122 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000122)= 0.000000 beta (00000122)= 13.255860 gamma(00000122)= 13.255860 z1= 1 0.260655263362680E-01 0.000000000000000E+00 Lanczos iteration: 123 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000123)= 0.000000 beta (00000123)= 12.762518 gamma(00000123)= 12.762518 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 124 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000124)= 0.000000 beta (00000124)= 13.343043 gamma(00000124)= 13.343043 z1= 1 -0.249314767182802E-01 0.000000000000000E+00 Lanczos iteration: 125 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000125)= 0.000000 beta (00000125)= 12.696831 gamma(00000125)= 12.696831 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 126 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000126)= 0.000000 beta (00000126)= 13.448554 gamma(00000126)= 13.448554 z1= 1 0.235379017698555E-01 0.000000000000000E+00 Lanczos iteration: 127 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000127)= 0.000000 beta (00000127)= 12.706993 gamma(00000127)= 12.706993 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 128 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000128)= 0.000000 beta (00000128)= 13.342767 gamma(00000128)= 13.342767 z1= 1 -0.224163363748700E-01 0.000000000000000E+00 Lanczos iteration: 129 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000129)= 0.000000 beta (00000129)= 12.730698 gamma(00000129)= 12.730698 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 130 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000130)= 0.000000 beta (00000130)= 13.329034 gamma(00000130)= 13.329034 z1= 1 0.214100734822483E-01 0.000000000000000E+00 Lanczos iteration: 131 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000131)= 0.000000 beta (00000131)= 12.650366 gamma(00000131)= 12.650366 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 132 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000132)= 0.000000 beta (00000132)= 13.181693 gamma(00000132)= 13.181693 z1= 1 -0.205470778420223E-01 0.000000000000000E+00 Lanczos iteration: 133 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000133)= 0.000000 beta (00000133)= 12.892525 gamma(00000133)= 12.892525 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 134 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000134)= 0.000000 beta (00000134)= 13.386310 gamma(00000134)= 13.386310 z1= 1 0.197891525095285E-01 0.000000000000000E+00 Lanczos iteration: 135 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000135)= 0.000000 beta (00000135)= 12.802779 gamma(00000135)= 12.802779 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 136 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000136)= 0.000000 beta (00000136)= 13.476087 gamma(00000136)= 13.476087 z1= 1 -0.188004243594491E-01 0.000000000000000E+00 Lanczos iteration: 137 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000137)= 0.000000 beta (00000137)= 12.858321 gamma(00000137)= 12.858321 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 138 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000138)= 0.000000 beta (00000138)= 13.406408 gamma(00000138)= 13.406408 z1= 1 0.180318164410805E-01 0.000000000000000E+00 Lanczos iteration: 139 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000139)= 0.000000 beta (00000139)= 13.037860 gamma(00000139)= 13.037860 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 140 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000140)= 0.000000 beta (00000140)= 13.371868 gamma(00000140)= 13.371868 z1= 1 -0.175814113170204E-01 0.000000000000000E+00 Lanczos iteration: 141 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000141)= 0.000000 beta (00000141)= 12.827424 gamma(00000141)= 12.827424 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 142 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000142)= 0.000000 beta (00000142)= 13.428544 gamma(00000142)= 13.428544 z1= 1 0.167943913952968E-01 0.000000000000000E+00 Lanczos iteration: 143 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000143)= 0.000000 beta (00000143)= 12.743634 gamma(00000143)= 12.743634 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 144 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000144)= 0.000000 beta (00000144)= 13.524438 gamma(00000144)= 13.524438 z1= 1 -0.158248034935927E-01 0.000000000000000E+00 Lanczos iteration: 145 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000145)= 0.000000 beta (00000145)= 12.872569 gamma(00000145)= 12.872569 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 146 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000146)= 0.000000 beta (00000146)= 13.347564 gamma(00000146)= 13.347564 z1= 1 0.152616515994966E-01 0.000000000000000E+00 Lanczos iteration: 147 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000147)= 0.000000 beta (00000147)= 13.002924 gamma(00000147)= 13.002924 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 148 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000148)= 0.000000 beta (00000148)= 13.454132 gamma(00000148)= 13.454132 z1= 1 -0.147498258309245E-01 0.000000000000000E+00 Lanczos iteration: 149 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000149)= 0.000000 beta (00000149)= 12.825453 gamma(00000149)= 12.825453 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 150 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000150)= 0.000000 beta (00000150)= 13.439910 gamma(00000150)= 13.439910 z1= 1 0.140754811028025E-01 0.000000000000000E+00 Lanczos iteration: 151 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000151)= 0.000000 beta (00000151)= 12.727430 gamma(00000151)= 12.727430 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 152 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000152)= 0.000000 beta (00000152)= 13.416055 gamma(00000152)= 13.416055 z1= 1 -0.133530084776585E-01 0.000000000000000E+00 Lanczos iteration: 153 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000153)= 0.000000 beta (00000153)= 12.475873 gamma(00000153)= 12.475873 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 154 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000154)= 0.000000 beta (00000154)= 13.472336 gamma(00000154)= 13.472336 z1= 1 0.123653709216691E-01 0.000000000000000E+00 Lanczos iteration: 155 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000155)= 0.000000 beta (00000155)= 12.764547 gamma(00000155)= 12.764547 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 156 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000156)= 0.000000 beta (00000156)= 13.416891 gamma(00000156)= 13.416891 z1= 1 -0.117641531799191E-01 0.000000000000000E+00 Lanczos iteration: 157 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000157)= 0.000000 beta (00000157)= 12.866242 gamma(00000157)= 12.866242 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 158 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000158)= 0.000000 beta (00000158)= 13.470125 gamma(00000158)= 13.470125 z1= 1 0.112367512202217E-01 0.000000000000000E+00 Lanczos iteration: 159 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000159)= 0.000000 beta (00000159)= 12.625790 gamma(00000159)= 12.625790 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 160 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000160)= 0.000000 beta (00000160)= 13.251706 gamma(00000160)= 13.251706 z1= 1 -0.107060076671296E-01 0.000000000000000E+00 Lanczos iteration: 161 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000161)= 0.000000 beta (00000161)= 12.558553 gamma(00000161)= 12.558553 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 162 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000162)= 0.000000 beta (00000162)= 13.409670 gamma(00000162)= 13.409670 z1= 1 0.100264939076097E-01 0.000000000000000E+00 Lanczos iteration: 163 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000163)= 0.000000 beta (00000163)= 12.630278 gamma(00000163)= 12.630278 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 164 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000164)= 0.000000 beta (00000164)= 13.170492 gamma(00000164)= 13.170492 z1= 1 -0.961523693459783E-02 0.000000000000000E+00 Lanczos iteration: 165 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000165)= 0.000000 beta (00000165)= 12.723558 gamma(00000165)= 12.723558 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 166 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000166)= 0.000000 beta (00000166)= 13.414611 gamma(00000166)= 13.414611 z1= 1 0.911990829014922E-02 0.000000000000000E+00 Lanczos iteration: 167 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000167)= 0.000000 beta (00000167)= 12.736133 gamma(00000167)= 12.736133 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 168 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000168)= 0.000000 beta (00000168)= 13.478487 gamma(00000168)= 13.478487 z1= 1 -0.861761166906630E-02 0.000000000000000E+00 Lanczos iteration: 169 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000169)= 0.000000 beta (00000169)= 12.666787 gamma(00000169)= 12.666787 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 170 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000170)= 0.000000 beta (00000170)= 13.351235 gamma(00000170)= 13.351235 z1= 1 0.817583191484974E-02 0.000000000000000E+00 Lanczos iteration: 171 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000171)= 0.000000 beta (00000171)= 12.748160 gamma(00000171)= 12.748160 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 172 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000172)= 0.000000 beta (00000172)= 13.387214 gamma(00000172)= 13.387214 z1= 1 -0.778554922350273E-02 0.000000000000000E+00 Lanczos iteration: 173 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000173)= 0.000000 beta (00000173)= 12.826011 gamma(00000173)= 12.826011 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 174 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000174)= 0.000000 beta (00000174)= 13.474121 gamma(00000174)= 13.474121 z1= 1 0.741106147089064E-02 0.000000000000000E+00 Lanczos iteration: 175 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000175)= 0.000000 beta (00000175)= 12.804064 gamma(00000175)= 12.804064 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 176 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000176)= 0.000000 beta (00000176)= 13.359969 gamma(00000176)= 13.359969 z1= 1 -0.710268923116240E-02 0.000000000000000E+00 Lanczos iteration: 177 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000177)= 0.000000 beta (00000177)= 12.755012 gamma(00000177)= 12.755012 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 178 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000178)= 0.000000 beta (00000178)= 13.288659 gamma(00000178)= 13.288659 z1= 1 0.681745864014097E-02 0.000000000000000E+00 Lanczos iteration: 179 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000179)= 0.000000 beta (00000179)= 12.690350 gamma(00000179)= 12.690350 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 180 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000180)= 0.000000 beta (00000180)= 13.437815 gamma(00000180)= 13.437815 z1= 1 -0.643824437431564E-02 0.000000000000000E+00 Lanczos iteration: 181 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000181)= 0.000000 beta (00000181)= 12.757733 gamma(00000181)= 12.757733 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 182 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000182)= 0.000000 beta (00000182)= 13.469648 gamma(00000182)= 13.469648 z1= 1 0.609796170709154E-02 0.000000000000000E+00 Lanczos iteration: 183 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000183)= 0.000000 beta (00000183)= 12.815021 gamma(00000183)= 12.815021 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 184 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000184)= 0.000000 beta (00000184)= 13.574583 gamma(00000184)= 13.574583 z1= 1 -0.575675192284361E-02 0.000000000000000E+00 Lanczos iteration: 185 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000185)= 0.000000 beta (00000185)= 12.793361 gamma(00000185)= 12.793361 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 186 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000186)= 0.000000 beta (00000186)= 13.292528 gamma(00000186)= 13.292528 z1= 1 0.554057171764938E-02 0.000000000000000E+00 Lanczos iteration: 187 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000187)= 0.000000 beta (00000187)= 12.797111 gamma(00000187)= 12.797111 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 188 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000188)= 0.000000 beta (00000188)= 13.481938 gamma(00000188)= 13.481938 z1= 1 -0.525913363089187E-02 0.000000000000000E+00 Lanczos iteration: 189 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000189)= 0.000000 beta (00000189)= 13.067552 gamma(00000189)= 13.067552 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 190 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000190)= 0.000000 beta (00000190)= 13.608469 gamma(00000190)= 13.608469 z1= 1 0.505009089829366E-02 0.000000000000000E+00 Lanczos iteration: 191 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000191)= 0.000000 beta (00000191)= 12.804334 gamma(00000191)= 12.804334 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 192 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000192)= 0.000000 beta (00000192)= 13.459684 gamma(00000192)= 13.459684 z1= 1 -0.480420280355465E-02 0.000000000000000E+00 Lanczos iteration: 193 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000193)= 0.000000 beta (00000193)= 12.669402 gamma(00000193)= 12.669402 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 194 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000194)= 0.000000 beta (00000194)= 13.206241 gamma(00000194)= 13.206241 z1= 1 0.460891021709486E-02 0.000000000000000E+00 Lanczos iteration: 195 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000195)= 0.000000 beta (00000195)= 12.760228 gamma(00000195)= 12.760228 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 196 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000196)= 0.000000 beta (00000196)= 13.186878 gamma(00000196)= 13.186878 z1= 1 -0.445979277623444E-02 0.000000000000000E+00 Lanczos iteration: 197 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000197)= 0.000000 beta (00000197)= 12.865474 gamma(00000197)= 12.865474 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 198 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000198)= 0.000000 beta (00000198)= 13.480535 gamma(00000198)= 13.480535 z1= 1 0.425631079256271E-02 0.000000000000000E+00 Lanczos iteration: 199 Pol:1 lr_apply_liouvillian: not applying interaction alpha(00000199)= 0.000000 beta (00000199)= 12.731924 gamma(00000199)= 12.731924 z1= 1 0.000000000000000E+00 0.000000000000000E+00 Lanczos iteration: 200 Pol:1 lr_apply_liouvillian: applying interaction: normal alpha(00000200)= 0.000000 beta (00000200)= 13.432538 gamma(00000200)= 13.432538 z1= 1 -0.403431024675000E-02 0.000000000000000E+00 End of Lanczos iterations Finished linear response calculation... lr_main : 84.14s CPU 37.89s WALL ( 1 calls) read_wf : 0.07s CPU 0.04s WALL ( 1 calls) lr_solve_e : 3.50s CPU 1.56s WALL ( 1 calls) one_step : 78.16s CPU 34.55s WALL ( 200 calls) lr_apply : 76.75s CPU 34.05s WALL ( 200 calls) lr_apply_int : 52.95s CPU 24.60s WALL ( 100 calls) lr_apply_no : 23.80s CPU 9.45s WALL ( 100 calls) h_psi : 39.04s CPU 16.96s WALL ( 214 calls) lr_calc_dens : 13.94s CPU 5.37s WALL ( 100 calls) lr_dvpsi_e : 3.44s CPU 1.52s WALL ( 1 calls) lr_dv_setup : 0.28s CPU 0.13s WALL ( 1 calls) dv_of_drho : 16.53s CPU 8.15s WALL ( 100 calls) interaction : 6.86s CPU 3.50s WALL ( 100 calls) lr_dot : 0.18s CPU 0.05s WALL ( 300 calls) ortho : 0.77s CPU 0.24s WALL ( 202 calls) US routines lr_sm1_psi : 0.10s CPU 0.04s WALL ( 200 calls) General routines calbec : 0.14s CPU 0.06s WALL ( 230 calls) fft : 13.56s CPU 6.74s WALL ( 203 calls) fftw : 52.12s CPU 22.45s WALL ( 1256 calls) interpolate : 0.18s CPU 0.08s WALL ( 100 calls) davcio : 0.29s CPU 0.19s WALL ( 11 calls) Parallel routines fft_scatter : 5.71s CPU 2.73s WALL ( 1459 calls) turboTDDFT : 1m24.17s CPU 0m37.91s WALL This run was terminated on: 14: 5:31 10Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=