---------------------------------------------------------------------------- c a u c h y - b o r n c o n s t i t u t i v e m o d e l This program computes the finite deformation constitutive response of an arbitrary multilattice single crystal. The code is based on the local quasicontinuum (QC) method (http://qcmethod.org). The program uses interatomic potentials compatible with the Knowledgebase of Interatomic Models (KIM) project (https://openkim.org). Copyright (C) 2015 E. B. Tadmor ---------------------------------------------------------------------------- Test calculation: Lattice invariance shear of cubic crystal **setting factor** * Default globaltol set to 0.10000E-15 CG global tolerance = 0.10000E-15 **reading material data** Material name 'Cu(bcc)' * Warning: for a simple bravais lattice * Warning: ShuffleOn is reset to ShuffleOn = FALSE material information Bravais lattice vectors: a1 = 2.00000 0.00000 0.00000 a2 = 0.00000 2.00000 0.00000 a3 = 1.00000 1.00000 1.00000 Basis atoms: Number of basis atoms = 1 spec mass reference shift vector 29 1.00 0.00000 0.00000 0.00000 **reading constitutive information** * Error: at line 169 in mod_poten_kim.F90 Message: kim_api_string_init KIM_STATUS_MSG: unsuccessful completion * Error: at line 208 in mod_poten_kim.F90 Message: kim_api_string_init KIM_STATUS_MSG: unsuccessful completion KIM Model name: EAM_Johnson_NearestNeighbor_Cu__MO_887933271505_001 Match failed; removing process_d2Edr2 and trying again. Moduli calculation disabled. Preconditioning disabled in lattice parameter optimization. Match failed; removing process_dEdr and trying again. Maximum cut-off distance: 3.5000000000 **global parameter settings** Number of spatial dimensions = 3 Number of dofs per node = 3 Number of nodes per element = 4 Shuffles optimization = OFF Prefer multilattice stress correction = OFF Optimize F and shuffles concurrently = ACTIVATED Use preconditioned CG optimization = OFF **optimize lattice parameter** Input lattice vectors 2.0000000000000000 0.0000000000000000 1.0000000000000000 0.0000000000000000 2.0000000000000000 1.0000000000000000 0.0000000000000000 0.0000000000000000 1.0000000000000000 Relaxed lattice vectors 1.99999999999999977796 0.00000000000000000000 0.99999999999999988898 0.00000000000000000000 1.99999999999999977796 0.99999999999999988898 0.00000000000000000000 0.00000000000000000000 0.99999999999999988898 **deform crystal** Method: fixed shifts Mode: multiple steps, nsteps = 100 Deformation gradient -1.00000000 -2.00000000 -2.00000000 2.00000000 3.00000000 2.00000000 0.00000000 0.00000000 1.00000000 *** step number: 0 *** Deformation gradient in current step 1.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 27.50346645 Kirchhoff stress -0.52190E+01 -0.31225E-16 -0.52042E-16 -0.31225E-16 -0.52190E+01 -0.58981E-16 -0.52042E-16 -0.58981E-16 -0.52190E+01 *** step number: 1 *** Deformation gradient in current step 0.98000000 -0.02000000 -0.02000000 0.02000000 1.02000000 0.02000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 28.85212182 Kirchhoff stress -0.53425E+01 0.61199E-01 -0.12423E+00 0.61199E-01 -0.52422E+01 0.14696E+00 -0.12423E+00 0.14696E+00 -0.52745E+01 *** step number: 2 *** Deformation gradient in current step 0.96000000 -0.04000000 -0.04000000 0.04000000 1.04000000 0.04000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 30.21317689 Kirchhoff stress -0.54321E+01 0.98286E-01 -0.28275E+00 0.98286E-01 -0.52099E+01 0.37196E+00 -0.28275E+00 0.37196E+00 -0.52548E+01 *** step number: 3 *** Deformation gradient in current step 0.94000000 -0.06000000 -0.06000000 0.06000000 1.06000000 0.06000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 31.65682246 Kirchhoff stress -0.56598E+01 0.12563E+00 -0.46745E+00 0.12563E+00 -0.55173E+01 0.50399E+00 -0.46745E+00 0.50399E+00 -0.53414E+01 *** step number: 4 *** Deformation gradient in current step 0.92000000 -0.08000000 -0.08000000 0.08000000 1.08000000 0.08000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 33.12932867 Kirchhoff stress -0.58273E+01 0.20173E+00 -0.61381E+00 0.20173E+00 -0.54543E+01 0.80195E+00 -0.61381E+00 0.80195E+00 -0.53033E+01 *** step number: 5 *** Deformation gradient in current step 0.90000000 -0.10000000 -0.10000000 0.10000000 1.10000000 0.10000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 34.68486163 Kirchhoff stress -0.61036E+01 0.27230E+00 -0.71861E+00 0.27230E+00 -0.55498E+01 0.11259E+01 -0.71861E+00 0.11259E+01 -0.54099E+01 *** step number: 6 *** Deformation gradient in current step 0.88000000 -0.12000000 -0.12000000 0.12000000 1.12000000 0.12000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 36.29715964 Kirchhoff stress -0.63771E+01 0.34307E+00 -0.89344E+00 0.34307E+00 -0.54562E+01 0.14820E+01 -0.89344E+00 0.14820E+01 -0.53742E+01 *** step number: 7 *** Deformation gradient in current step 0.86000000 -0.14000000 -0.14000000 0.14000000 1.14000000 0.14000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 37.96400514 Kirchhoff stress -0.65447E+01 0.41472E+00 -0.10891E+01 0.41472E+00 -0.53355E+01 0.18594E+01 -0.10891E+01 0.18594E+01 -0.53411E+01 *** step number: 8 *** Deformation gradient in current step 0.84000000 -0.16000000 -0.16000000 0.16000000 1.16000000 0.16000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 39.76538667 Kirchhoff stress -0.69472E+01 0.47548E+00 -0.13314E+01 0.47548E+00 -0.54073E+01 0.22311E+01 -0.13314E+01 0.22311E+01 -0.54896E+01 *** step number: 9 *** Deformation gradient in current step 0.82000000 -0.18000000 -0.18000000 0.18000000 1.18000000 0.18000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 41.70087023 Kirchhoff stress -0.73834E+01 0.41529E+00 -0.15376E+01 0.41529E+00 -0.53775E+01 0.26954E+01 -0.15376E+01 0.26954E+01 -0.55720E+01 *** step number: 10 *** Deformation gradient in current step 0.80000000 -0.20000000 -0.20000000 0.20000000 1.20000000 0.20000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 43.79248344 Kirchhoff stress -0.78176E+01 0.38067E+00 -0.17941E+01 0.38067E+00 -0.53822E+01 0.30496E+01 -0.17941E+01 0.30496E+01 -0.56846E+01 *** step number: 11 *** Deformation gradient in current step 0.78000000 -0.22000000 -0.22000000 0.22000000 1.22000000 0.22000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 46.04197570 Kirchhoff stress -0.82405E+01 0.27236E+00 -0.20962E+01 0.27236E+00 -0.52994E+01 0.34720E+01 -0.20962E+01 0.34720E+01 -0.57704E+01 *** step number: 12 *** Deformation gradient in current step 0.76000000 -0.24000000 -0.24000000 0.24000000 1.24000000 0.24000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 48.47388042 Kirchhoff stress -0.86632E+01 0.11534E+00 -0.24246E+01 0.11534E+00 -0.52499E+01 0.38898E+01 -0.24246E+01 0.38898E+01 -0.59017E+01 *** step number: 13 *** Deformation gradient in current step 0.74000000 -0.26000000 -0.26000000 0.26000000 1.26000000 0.26000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 51.08942933 Kirchhoff stress -0.90168E+01 -0.81292E-01 -0.27101E+01 -0.81292E-01 -0.52254E+01 0.43079E+01 -0.27101E+01 0.43079E+01 -0.59499E+01 *** step number: 14 *** Deformation gradient in current step 0.72000000 -0.28000000 -0.28000000 0.28000000 1.28000000 0.28000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 53.91093913 Kirchhoff stress -0.93158E+01 -0.27631E+00 -0.30253E+01 -0.27631E+00 -0.52146E+01 0.47488E+01 -0.30253E+01 0.47488E+01 -0.61082E+01 *** step number: 15 *** Deformation gradient in current step 0.70000000 -0.30000000 -0.30000000 0.30000000 1.30000000 0.30000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 56.98062436 Kirchhoff stress -0.96618E+01 -0.55239E+00 -0.34206E+01 -0.55239E+00 -0.52980E+01 0.51426E+01 -0.34206E+01 0.51426E+01 -0.63850E+01 *** step number: 16 *** Deformation gradient in current step 0.68000000 -0.32000000 -0.32000000 0.32000000 1.32000000 0.32000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 60.29478096 Kirchhoff stress -0.98392E+01 -0.88324E+00 -0.37601E+01 -0.88324E+00 -0.54140E+01 0.54968E+01 -0.37601E+01 0.54968E+01 -0.66535E+01 *** step number: 17 *** Deformation gradient in current step 0.66000000 -0.34000000 -0.34000000 0.34000000 1.34000000 0.34000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 63.89085995 Kirchhoff stress -0.10060E+02 -0.12092E+01 -0.41821E+01 -0.12092E+01 -0.56063E+01 0.58533E+01 -0.41821E+01 0.58533E+01 -0.70459E+01 *** step number: 18 *** Deformation gradient in current step 0.64000000 -0.36000000 -0.36000000 0.36000000 1.36000000 0.36000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 67.75928247 Kirchhoff stress -0.10049E+02 -0.15072E+01 -0.45707E+01 -0.15072E+01 -0.58271E+01 0.61953E+01 -0.45707E+01 0.61953E+01 -0.74753E+01 *** step number: 19 *** Deformation gradient in current step 0.62000000 -0.38000000 -0.38000000 0.38000000 1.38000000 0.38000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 71.92931699 Kirchhoff stress -0.99648E+01 -0.19047E+01 -0.50116E+01 -0.19047E+01 -0.62322E+01 0.65082E+01 -0.50116E+01 0.65082E+01 -0.79990E+01 *** step number: 20 *** Deformation gradient in current step 0.60000000 -0.40000000 -0.40000000 0.40000000 1.40000000 0.40000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 76.43039190 Kirchhoff stress -0.99718E+01 -0.22648E+01 -0.55034E+01 -0.22648E+01 -0.66297E+01 0.67389E+01 -0.55034E+01 0.67389E+01 -0.86597E+01 *** step number: 21 *** Deformation gradient in current step 0.58000000 -0.42000000 -0.42000000 0.42000000 1.42000000 0.42000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 81.24566437 Kirchhoff stress -0.98397E+01 -0.25485E+01 -0.59506E+01 -0.25485E+01 -0.69748E+01 0.69972E+01 -0.59506E+01 0.69972E+01 -0.93266E+01 *** step number: 22 *** Deformation gradient in current step 0.56000000 -0.44000000 -0.44000000 0.44000000 1.44000000 0.44000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 86.37836849 Kirchhoff stress -0.96254E+01 -0.27998E+01 -0.63968E+01 -0.27998E+01 -0.73389E+01 0.72256E+01 -0.63968E+01 0.72256E+01 -0.10068E+02 *** step number: 23 *** Deformation gradient in current step 0.54000000 -0.46000000 -0.46000000 0.46000000 1.46000000 0.46000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 91.85129097 Kirchhoff stress -0.93535E+01 -0.30430E+01 -0.68496E+01 -0.30430E+01 -0.78616E+01 0.73844E+01 -0.68496E+01 0.73844E+01 -0.10914E+02 *** step number: 24 *** Deformation gradient in current step 0.52000000 -0.48000000 -0.48000000 0.48000000 1.48000000 0.48000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 97.63759113 Kirchhoff stress -0.89805E+01 -0.32010E+01 -0.72744E+01 -0.32010E+01 -0.82112E+01 0.75503E+01 -0.72744E+01 0.75503E+01 -0.11800E+02 *** step number: 25 *** Deformation gradient in current step 0.50000000 -0.50000000 -0.50000000 0.50000000 1.50000000 0.50000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 103.7335983 Kirchhoff stress -0.85407E+01 -0.33104E+01 -0.76803E+01 -0.33104E+01 -0.85407E+01 0.76803E+01 -0.76803E+01 0.76803E+01 -0.12760E+02 *** step number: 26 *** Deformation gradient in current step 0.48000000 -0.52000000 -0.52000000 0.52000000 1.52000000 0.52000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 110.1337221 Kirchhoff stress -0.80414E+01 -0.33690E+01 -0.80599E+01 -0.33690E+01 -0.88377E+01 0.77734E+01 -0.80599E+01 0.77734E+01 -0.13788E+02 *** step number: 27 *** Deformation gradient in current step 0.46000000 -0.54000000 -0.54000000 0.54000000 1.54000000 0.54000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 116.8306862 Kirchhoff stress -0.74911E+01 -0.33766E+01 -0.84049E+01 -0.33766E+01 -0.90904E+01 0.78294E+01 -0.84049E+01 0.78294E+01 -0.14880E+02 *** step number: 28 *** Deformation gradient in current step 0.44000000 -0.56000000 -0.56000000 0.56000000 1.56000000 0.56000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 123.8394173 Kirchhoff stress -0.69128E+01 -0.33431E+01 -0.87208E+01 -0.33431E+01 -0.93481E+01 0.77801E+01 -0.87208E+01 0.77801E+01 -0.16170E+02 *** step number: 29 *** Deformation gradient in current step 0.42000000 -0.58000000 -0.58000000 0.58000000 1.58000000 0.58000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 131.0752123 Kirchhoff stress -0.60866E+01 -0.32317E+01 -0.89487E+01 -0.32317E+01 -0.94177E+01 0.76944E+01 -0.89487E+01 0.76944E+01 -0.17179E+02 *** step number: 30 *** Deformation gradient in current step 0.40000000 -0.60000000 -0.60000000 0.60000000 1.60000000 0.60000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 138.5715771 Kirchhoff stress -0.54280E+01 -0.30900E+01 -0.91379E+01 -0.30900E+01 -0.94716E+01 0.76459E+01 -0.91379E+01 0.76459E+01 -0.18390E+02 *** step number: 31 *** Deformation gradient in current step 0.38000000 -0.62000000 -0.62000000 0.62000000 1.62000000 0.62000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 146.2669104 Kirchhoff stress -0.45179E+01 -0.28970E+01 -0.91410E+01 -0.28970E+01 -0.93505E+01 0.75938E+01 -0.91410E+01 0.75938E+01 -0.19522E+02 *** step number: 32 *** Deformation gradient in current step 0.36000000 -0.64000000 -0.64000000 0.64000000 1.64000000 0.64000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 154.1672334 Kirchhoff stress -0.35914E+01 -0.26778E+01 -0.91516E+01 -0.26778E+01 -0.92683E+01 0.74563E+01 -0.91516E+01 0.74563E+01 -0.20745E+02 *** step number: 33 *** Deformation gradient in current step 0.34000000 -0.66000000 -0.66000000 0.66000000 1.66000000 0.66000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 162.2535244 Kirchhoff stress -0.28403E+01 -0.24285E+01 -0.90449E+01 -0.24285E+01 -0.90149E+01 0.73415E+01 -0.90449E+01 0.73415E+01 -0.21851E+02 *** step number: 34 *** Deformation gradient in current step 0.32000000 -0.68000000 -0.68000000 0.68000000 1.68000000 0.68000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 170.5382114 Kirchhoff stress -0.21701E+01 -0.21705E+01 -0.89504E+01 -0.21705E+01 -0.86898E+01 0.72017E+01 -0.89504E+01 0.72017E+01 -0.23111E+02 *** step number: 35 *** Deformation gradient in current step 0.30000000 -0.70000000 -0.70000000 0.70000000 1.70000000 0.70000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 179.0331074 Kirchhoff stress -0.15515E+01 -0.18769E+01 -0.87712E+01 -0.18769E+01 -0.83973E+01 0.69702E+01 -0.87712E+01 0.69702E+01 -0.24445E+02 *** step number: 36 *** Deformation gradient in current step 0.28000000 -0.72000000 -0.72000000 0.72000000 1.72000000 0.72000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 187.7251071 Kirchhoff stress -0.98450E+00 -0.15630E+01 -0.85313E+01 -0.15630E+01 -0.80426E+01 0.67573E+01 -0.85313E+01 0.67573E+01 -0.25721E+02 *** step number: 37 *** Deformation gradient in current step 0.26000000 -0.74000000 -0.74000000 0.74000000 1.74000000 0.74000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 196.6011155 Kirchhoff stress -0.47944E+00 -0.13652E+01 -0.82873E+01 -0.13652E+01 -0.75358E+01 0.65013E+01 -0.82873E+01 0.65013E+01 -0.27018E+02 *** step number: 38 *** Deformation gradient in current step 0.24000000 -0.76000000 -0.76000000 0.76000000 1.76000000 0.76000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 205.6491065 Kirchhoff stress 0.14450E+00 -0.10956E+01 -0.78176E+01 -0.10956E+01 -0.70475E+01 0.62879E+01 -0.78176E+01 0.62879E+01 -0.28356E+02 *** step number: 39 *** Deformation gradient in current step 0.22000000 -0.78000000 -0.78000000 0.78000000 1.78000000 0.78000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 214.8314899 Kirchhoff stress 0.59883E+00 -0.86155E+00 -0.74003E+01 -0.86155E+00 -0.63068E+01 0.60352E+01 -0.74003E+01 0.60352E+01 -0.29492E+02 *** step number: 40 *** Deformation gradient in current step 0.20000000 -0.80000000 -0.80000000 0.80000000 1.80000000 0.80000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 224.1652112 Kirchhoff stress 0.93252E+00 -0.66252E+00 -0.68589E+01 -0.66252E+00 -0.55403E+01 0.57548E+01 -0.68589E+01 0.57548E+01 -0.30737E+02 *** step number: 41 *** Deformation gradient in current step 0.18000000 -0.82000000 -0.82000000 0.82000000 1.82000000 0.82000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 233.5910185 Kirchhoff stress 0.13764E+01 -0.51736E+00 -0.62526E+01 -0.51736E+00 -0.47079E+01 0.53930E+01 -0.62526E+01 0.53930E+01 -0.31687E+02 *** step number: 42 *** Deformation gradient in current step 0.16000000 -0.84000000 -0.84000000 0.84000000 1.84000000 0.84000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 243.0991109 Kirchhoff stress 0.17246E+01 -0.31918E+00 -0.57434E+01 -0.31918E+00 -0.38342E+01 0.49553E+01 -0.57434E+01 0.49553E+01 -0.32566E+02 *** step number: 43 *** Deformation gradient in current step 0.14000000 -0.86000000 -0.86000000 0.86000000 1.86000000 0.86000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 252.7294220 Kirchhoff stress 0.18998E+01 -0.24147E+00 -0.51416E+01 -0.24147E+00 -0.31839E+01 0.44708E+01 -0.51416E+01 0.44708E+01 -0.33490E+02 *** step number: 44 *** Deformation gradient in current step 0.12000000 -0.88000000 -0.88000000 0.88000000 1.88000000 0.88000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 262.4678476 Kirchhoff stress 0.20104E+01 -0.17415E+00 -0.44894E+01 -0.17415E+00 -0.25473E+01 0.39827E+01 -0.44894E+01 0.39827E+01 -0.34308E+02 *** step number: 45 *** Deformation gradient in current step 0.10000000 -0.90000000 -0.90000000 0.90000000 1.90000000 0.90000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 272.2797061 Kirchhoff stress 0.20582E+01 -0.10539E+00 -0.38033E+01 -0.10539E+00 -0.17641E+01 0.34390E+01 -0.38033E+01 0.34390E+01 -0.35005E+02 *** step number: 46 *** Deformation gradient in current step 0.08000000 -0.92000000 -0.92000000 0.92000000 1.92000000 0.92000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 282.1545626 Kirchhoff stress 0.20291E+01 -0.59092E-01 -0.30912E+01 -0.59092E-01 -0.10356E+01 0.28442E+01 -0.30912E+01 0.28442E+01 -0.35596E+02 *** step number: 47 *** Deformation gradient in current step 0.06000000 -0.94000000 -0.94000000 0.94000000 1.94000000 0.94000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 292.0808928 Kirchhoff stress 0.19212E+01 -0.29869E-01 -0.23595E+01 -0.29869E-01 -0.37263E+00 0.22026E+01 -0.23595E+01 0.22026E+01 -0.36073E+02 *** step number: 48 *** Deformation gradient in current step 0.04000000 -0.96000000 -0.96000000 0.96000000 1.96000000 0.96000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 302.0449831 Kirchhoff stress 0.18066E+01 0.40396E-01 -0.15575E+01 0.40396E-01 0.21723E+00 0.14967E+01 -0.15575E+01 0.14967E+01 -0.36491E+02 *** step number: 49 *** Deformation gradient in current step 0.02000000 -0.98000000 -0.98000000 0.98000000 1.98000000 0.98000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 312.0317713 Kirchhoff stress 0.15314E+01 0.54343E-01 -0.80609E+00 0.54343E-01 0.73560E+00 0.79086E+00 -0.80609E+00 0.79086E+00 -0.36698E+02 *** step number: 50 *** Deformation gradient in current step 0.00000000 -1.00000000 -1.00000000 1.00000000 2.00000000 1.00000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 322.0014997 Kirchhoff stress 0.12433E+01 0.93675E-16 0.10061E-15 0.93675E-16 0.12433E+01 -0.12837E-15 0.10061E-15 -0.12837E-15 -0.36684E+02 *** step number: 51 *** Deformation gradient in current step -0.02000000 -1.02000000 -1.02000000 1.02000000 2.02000000 1.02000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 331.9882880 Kirchhoff stress 0.73560E+00 0.54343E-01 0.79086E+00 0.54343E-01 0.15314E+01 -0.80609E+00 0.79086E+00 -0.80609E+00 -0.36698E+02 *** step number: 52 *** Deformation gradient in current step -0.04000000 -1.04000000 -1.04000000 1.04000000 2.04000000 1.04000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 341.9523783 Kirchhoff stress 0.21723E+00 0.40396E-01 0.14967E+01 0.40396E-01 0.18066E+01 -0.15575E+01 0.14967E+01 -0.15575E+01 -0.36491E+02 *** step number: 53 *** Deformation gradient in current step -0.06000000 -1.06000000 -1.06000000 1.06000000 2.06000000 1.06000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 351.8787084 Kirchhoff stress -0.37263E+00 -0.29869E-01 0.22026E+01 -0.29869E-01 0.19212E+01 -0.23595E+01 0.22026E+01 -0.23595E+01 -0.36073E+02 *** step number: 54 *** Deformation gradient in current step -0.08000000 -1.08000000 -1.08000000 1.08000000 2.08000000 1.08000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 361.7535649 Kirchhoff stress -0.10356E+01 -0.59092E-01 0.28442E+01 -0.59092E-01 0.20291E+01 -0.30912E+01 0.28442E+01 -0.30912E+01 -0.35596E+02 *** step number: 55 *** Deformation gradient in current step -0.10000000 -1.10000000 -1.10000000 1.10000000 2.10000000 1.10000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 371.5654234 Kirchhoff stress -0.17641E+01 -0.10539E+00 0.34390E+01 -0.10539E+00 0.20582E+01 -0.38033E+01 0.34390E+01 -0.38033E+01 -0.35005E+02 *** step number: 56 *** Deformation gradient in current step -0.12000000 -1.12000000 -1.12000000 1.12000000 2.12000000 1.12000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 381.3038490 Kirchhoff stress -0.25473E+01 -0.17415E+00 0.39827E+01 -0.17415E+00 0.20104E+01 -0.44894E+01 0.39827E+01 -0.44894E+01 -0.34308E+02 *** step number: 57 *** Deformation gradient in current step -0.14000000 -1.14000000 -1.14000000 1.14000000 2.14000000 1.14000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 390.9341601 Kirchhoff stress -0.31839E+01 -0.24147E+00 0.44708E+01 -0.24147E+00 0.18998E+01 -0.51416E+01 0.44708E+01 -0.51416E+01 -0.33490E+02 *** step number: 58 *** Deformation gradient in current step -0.16000000 -1.16000000 -1.16000000 1.16000000 2.16000000 1.16000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 400.4422526 Kirchhoff stress -0.38342E+01 -0.31918E+00 0.49553E+01 -0.31918E+00 0.17246E+01 -0.57434E+01 0.49553E+01 -0.57434E+01 -0.32566E+02 *** step number: 59 *** Deformation gradient in current step -0.18000000 -1.18000000 -1.18000000 1.18000000 2.18000000 1.18000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 409.8680598 Kirchhoff stress -0.47079E+01 -0.51736E+00 0.53930E+01 -0.51736E+00 0.13764E+01 -0.62526E+01 0.53930E+01 -0.62526E+01 -0.31687E+02 *** step number: 60 *** Deformation gradient in current step -0.20000000 -1.20000000 -1.20000000 1.20000000 2.20000000 1.20000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 419.2017811 Kirchhoff stress -0.55403E+01 -0.66252E+00 0.57548E+01 -0.66252E+00 0.93252E+00 -0.68589E+01 0.57548E+01 -0.68589E+01 -0.30737E+02 *** step number: 61 *** Deformation gradient in current step -0.22000000 -1.22000000 -1.22000000 1.22000000 2.22000000 1.22000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 428.3841645 Kirchhoff stress -0.63068E+01 -0.86155E+00 0.60352E+01 -0.86155E+00 0.59883E+00 -0.74003E+01 0.60352E+01 -0.74003E+01 -0.29492E+02 *** step number: 62 *** Deformation gradient in current step -0.24000000 -1.24000000 -1.24000000 1.24000000 2.24000000 1.24000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 437.4321556 Kirchhoff stress -0.70475E+01 -0.10956E+01 0.62879E+01 -0.10956E+01 0.14450E+00 -0.78176E+01 0.62879E+01 -0.78176E+01 -0.28356E+02 *** step number: 63 *** Deformation gradient in current step -0.26000000 -1.26000000 -1.26000000 1.26000000 2.26000000 1.26000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 446.3081639 Kirchhoff stress -0.75358E+01 -0.13652E+01 0.65013E+01 -0.13652E+01 -0.47944E+00 -0.82873E+01 0.65013E+01 -0.82873E+01 -0.27018E+02 *** step number: 64 *** Deformation gradient in current step -0.28000000 -1.28000000 -1.28000000 1.28000000 2.28000000 1.28000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 455.0001637 Kirchhoff stress -0.80426E+01 -0.15630E+01 0.67573E+01 -0.15630E+01 -0.98450E+00 -0.85313E+01 0.67573E+01 -0.85313E+01 -0.25721E+02 *** step number: 65 *** Deformation gradient in current step -0.30000000 -1.30000000 -1.30000000 1.30000000 2.30000000 1.30000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 463.4950596 Kirchhoff stress -0.83973E+01 -0.18769E+01 0.69702E+01 -0.18769E+01 -0.15515E+01 -0.87712E+01 0.69702E+01 -0.87712E+01 -0.24445E+02 *** step number: 66 *** Deformation gradient in current step -0.32000000 -1.32000000 -1.32000000 1.32000000 2.32000000 1.32000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 471.7797466 Kirchhoff stress -0.86898E+01 -0.21705E+01 0.72017E+01 -0.21705E+01 -0.21701E+01 -0.89504E+01 0.72017E+01 -0.89504E+01 -0.23111E+02 *** step number: 67 *** Deformation gradient in current step -0.34000000 -1.34000000 -1.34000000 1.34000000 2.34000000 1.34000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 479.8660376 Kirchhoff stress -0.90149E+01 -0.24285E+01 0.73415E+01 -0.24285E+01 -0.28403E+01 -0.90449E+01 0.73415E+01 -0.90449E+01 -0.21851E+02 *** step number: 68 *** Deformation gradient in current step -0.36000000 -1.36000000 -1.36000000 1.36000000 2.36000000 1.36000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 487.7663606 Kirchhoff stress -0.92683E+01 -0.26778E+01 0.74563E+01 -0.26778E+01 -0.35914E+01 -0.91516E+01 0.74563E+01 -0.91516E+01 -0.20745E+02 *** step number: 69 *** Deformation gradient in current step -0.38000000 -1.38000000 -1.38000000 1.38000000 2.38000000 1.38000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 495.4616939 Kirchhoff stress -0.93505E+01 -0.28970E+01 0.75938E+01 -0.28970E+01 -0.45179E+01 -0.91410E+01 0.75938E+01 -0.91410E+01 -0.19522E+02 *** step number: 70 *** Deformation gradient in current step -0.40000000 -1.40000000 -1.40000000 1.40000000 2.40000000 1.40000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 502.9580587 Kirchhoff stress -0.94716E+01 -0.30900E+01 0.76459E+01 -0.30900E+01 -0.54280E+01 -0.91379E+01 0.76459E+01 -0.91379E+01 -0.18390E+02 *** step number: 71 *** Deformation gradient in current step -0.42000000 -1.42000000 -1.42000000 1.42000000 2.42000000 1.42000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 510.1938537 Kirchhoff stress -0.94177E+01 -0.32317E+01 0.76944E+01 -0.32317E+01 -0.60866E+01 -0.89487E+01 0.76944E+01 -0.89487E+01 -0.17179E+02 *** step number: 72 *** Deformation gradient in current step -0.44000000 -1.44000000 -1.44000000 1.44000000 2.44000000 1.44000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 517.2025848 Kirchhoff stress -0.93481E+01 -0.33431E+01 0.77801E+01 -0.33431E+01 -0.69128E+01 -0.87208E+01 0.77801E+01 -0.87208E+01 -0.16170E+02 *** step number: 73 *** Deformation gradient in current step -0.46000000 -1.46000000 -1.46000000 1.46000000 2.46000000 1.46000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 523.8995489 Kirchhoff stress -0.90904E+01 -0.33766E+01 0.78294E+01 -0.33766E+01 -0.74911E+01 -0.84049E+01 0.78294E+01 -0.84049E+01 -0.14880E+02 *** step number: 74 *** Deformation gradient in current step -0.48000000 -1.48000000 -1.48000000 1.48000000 2.48000000 1.48000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 530.2996728 Kirchhoff stress -0.88377E+01 -0.33690E+01 0.77734E+01 -0.33690E+01 -0.80414E+01 -0.80599E+01 0.77734E+01 -0.80599E+01 -0.13788E+02 *** step number: 75 *** Deformation gradient in current step -0.50000000 -1.50000000 -1.50000000 1.50000000 2.50000000 1.50000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 536.3956799 Kirchhoff stress -0.85407E+01 -0.33104E+01 0.76803E+01 -0.33104E+01 -0.85407E+01 -0.76803E+01 0.76803E+01 -0.76803E+01 -0.12760E+02 *** step number: 76 *** Deformation gradient in current step -0.52000000 -1.52000000 -1.52000000 1.52000000 2.52000000 1.52000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 542.1819801 Kirchhoff stress -0.82112E+01 -0.32010E+01 0.75503E+01 -0.32010E+01 -0.89805E+01 -0.72744E+01 0.75503E+01 -0.72744E+01 -0.11800E+02 *** step number: 77 *** Deformation gradient in current step -0.54000000 -1.54000000 -1.54000000 1.54000000 2.54000000 1.54000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 547.6549025 Kirchhoff stress -0.78616E+01 -0.30430E+01 0.73844E+01 -0.30430E+01 -0.93535E+01 -0.68496E+01 0.73844E+01 -0.68496E+01 -0.10914E+02 *** step number: 78 *** Deformation gradient in current step -0.56000000 -1.56000000 -1.56000000 1.56000000 2.56000000 1.56000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 552.7876066 Kirchhoff stress -0.73389E+01 -0.27998E+01 0.72256E+01 -0.27998E+01 -0.96254E+01 -0.63968E+01 0.72256E+01 -0.63968E+01 -0.10068E+02 *** step number: 79 *** Deformation gradient in current step -0.58000000 -1.58000000 -1.58000000 1.58000000 2.58000000 1.58000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 557.6028791 Kirchhoff stress -0.69748E+01 -0.25485E+01 0.69972E+01 -0.25485E+01 -0.98397E+01 -0.59506E+01 0.69972E+01 -0.59506E+01 -0.93266E+01 *** step number: 80 *** Deformation gradient in current step -0.60000000 -1.60000000 -1.60000000 1.60000000 2.60000000 1.60000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 562.1039540 Kirchhoff stress -0.66297E+01 -0.22648E+01 0.67389E+01 -0.22648E+01 -0.99718E+01 -0.55034E+01 0.67389E+01 -0.55034E+01 -0.86597E+01 *** step number: 81 *** Deformation gradient in current step -0.62000000 -1.62000000 -1.62000000 1.62000000 2.62000000 1.62000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 566.2739885 Kirchhoff stress -0.62322E+01 -0.19047E+01 0.65082E+01 -0.19047E+01 -0.99648E+01 -0.50116E+01 0.65082E+01 -0.50116E+01 -0.79990E+01 *** step number: 82 *** Deformation gradient in current step -0.64000000 -1.64000000 -1.64000000 1.64000000 2.64000000 1.64000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 570.1424111 Kirchhoff stress -0.58271E+01 -0.15072E+01 0.61953E+01 -0.15072E+01 -0.10049E+02 -0.45707E+01 0.61953E+01 -0.45707E+01 -0.74753E+01 *** step number: 83 *** Deformation gradient in current step -0.66000000 -1.66000000 -1.66000000 1.66000000 2.66000000 1.66000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 573.7384901 Kirchhoff stress -0.56063E+01 -0.12092E+01 0.58533E+01 -0.12092E+01 -0.10060E+02 -0.41821E+01 0.58533E+01 -0.41821E+01 -0.70459E+01 *** step number: 84 *** Deformation gradient in current step -0.68000000 -1.68000000 -1.68000000 1.68000000 2.68000000 1.68000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 577.0526467 Kirchhoff stress -0.54140E+01 -0.88324E+00 0.54968E+01 -0.88324E+00 -0.98392E+01 -0.37601E+01 0.54968E+01 -0.37601E+01 -0.66535E+01 *** step number: 85 *** Deformation gradient in current step -0.70000000 -1.70000000 -1.70000000 1.70000000 2.70000000 1.70000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 580.1223319 Kirchhoff stress -0.52980E+01 -0.55239E+00 0.51426E+01 -0.55239E+00 -0.96618E+01 -0.34206E+01 0.51426E+01 -0.34206E+01 -0.63850E+01 *** step number: 86 *** Deformation gradient in current step -0.72000000 -1.72000000 -1.72000000 1.72000000 2.72000000 1.72000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 582.9438417 Kirchhoff stress -0.52146E+01 -0.27631E+00 0.47488E+01 -0.27631E+00 -0.93158E+01 -0.30253E+01 0.47488E+01 -0.30253E+01 -0.61082E+01 *** step number: 87 *** Deformation gradient in current step -0.74000000 -1.74000000 -1.74000000 1.74000000 2.74000000 1.74000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 585.5593906 Kirchhoff stress -0.52254E+01 -0.81292E-01 0.43079E+01 -0.81292E-01 -0.90168E+01 -0.27101E+01 0.43079E+01 -0.27101E+01 -0.59499E+01 *** step number: 88 *** Deformation gradient in current step -0.76000000 -1.76000000 -1.76000000 1.76000000 2.76000000 1.76000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 587.9912953 Kirchhoff stress -0.52499E+01 0.11534E+00 0.38898E+01 0.11534E+00 -0.86632E+01 -0.24246E+01 0.38898E+01 -0.24246E+01 -0.59017E+01 *** step number: 89 *** Deformation gradient in current step -0.78000000 -1.78000000 -1.78000000 1.78000000 2.78000000 1.78000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 590.2407876 Kirchhoff stress -0.52994E+01 0.27236E+00 0.34720E+01 0.27236E+00 -0.82405E+01 -0.20962E+01 0.34720E+01 -0.20962E+01 -0.57704E+01 *** step number: 90 *** Deformation gradient in current step -0.80000000 -1.80000000 -1.80000000 1.80000000 2.80000000 1.80000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 592.3324008 Kirchhoff stress -0.53822E+01 0.38067E+00 0.30496E+01 0.38067E+00 -0.78176E+01 -0.17941E+01 0.30496E+01 -0.17941E+01 -0.56846E+01 *** step number: 91 *** Deformation gradient in current step -0.82000000 -1.82000000 -1.82000000 1.82000000 2.82000000 1.82000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 594.2678844 Kirchhoff stress -0.53775E+01 0.41529E+00 0.26954E+01 0.41529E+00 -0.73834E+01 -0.15376E+01 0.26954E+01 -0.15376E+01 -0.55720E+01 *** step number: 92 *** Deformation gradient in current step -0.84000000 -1.84000000 -1.84000000 1.84000000 2.84000000 1.84000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 596.0692659 Kirchhoff stress -0.54073E+01 0.47548E+00 0.22311E+01 0.47548E+00 -0.69472E+01 -0.13314E+01 0.22311E+01 -0.13314E+01 -0.54896E+01 *** step number: 93 *** Deformation gradient in current step -0.86000000 -1.86000000 -1.86000000 1.86000000 2.86000000 1.86000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 597.7361114 Kirchhoff stress -0.53355E+01 0.41472E+00 0.18594E+01 0.41472E+00 -0.65447E+01 -0.10891E+01 0.18594E+01 -0.10891E+01 -0.53411E+01 *** step number: 94 *** Deformation gradient in current step -0.88000000 -1.88000000 -1.88000000 1.88000000 2.88000000 1.88000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 599.3484094 Kirchhoff stress -0.54562E+01 0.34307E+00 0.14820E+01 0.34307E+00 -0.63771E+01 -0.89344E+00 0.14820E+01 -0.89344E+00 -0.53742E+01 *** step number: 95 *** Deformation gradient in current step -0.90000000 -1.90000000 -1.90000000 1.90000000 2.90000000 1.90000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 600.9039423 Kirchhoff stress -0.55498E+01 0.27230E+00 0.11259E+01 0.27230E+00 -0.61036E+01 -0.71861E+00 0.11259E+01 -0.71861E+00 -0.54099E+01 *** step number: 96 *** Deformation gradient in current step -0.92000000 -1.92000000 -1.92000000 1.92000000 2.92000000 1.92000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 602.3764486 Kirchhoff stress -0.54543E+01 0.20173E+00 0.80195E+00 0.20173E+00 -0.58273E+01 -0.61381E+00 0.80195E+00 -0.61381E+00 -0.53033E+01 *** step number: 97 *** Deformation gradient in current step -0.94000000 -1.94000000 -1.94000000 1.94000000 2.94000000 1.94000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 603.8200941 Kirchhoff stress -0.55173E+01 0.12563E+00 0.50399E+00 0.12563E+00 -0.56598E+01 -0.46745E+00 0.50399E+00 -0.46745E+00 -0.53414E+01 *** step number: 98 *** Deformation gradient in current step -0.96000000 -1.96000000 -1.96000000 1.96000000 2.96000000 1.96000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 605.1811492 Kirchhoff stress -0.52099E+01 0.98286E-01 0.37196E+00 0.98286E-01 -0.54321E+01 -0.28275E+00 0.37196E+00 -0.28275E+00 -0.52548E+01 *** step number: 99 *** Deformation gradient in current step -0.98000000 -1.98000000 -1.98000000 1.98000000 2.98000000 1.98000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 606.5298046 Kirchhoff stress -0.52422E+01 0.61199E-01 0.14696E+00 0.61199E-01 -0.53425E+01 -0.12423E+00 0.14696E+00 -0.12423E+00 -0.52745E+01 *** step number: 100 *** Deformation gradient in current step -1.00000000 -2.00000000 -2.00000000 2.00000000 3.00000000 2.00000000 0.00000000 0.00000000 1.00000000 energy density (per reference volume) = 607.8536700 Kirchhoff stress -0.52190E+01 0.55962E-14 0.33480E-14 0.55962E-14 -0.52190E+01 0.43975E-14 0.33480E-14 0.43975E-14 -0.52190E+01 * CB-KIM calculation successfully completed