{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.622573 -3.6431812 0.4464602 ] [ -12.5411049 7.6161908 -14.2012215 ] [ -5.3910315 -2.0507124 5.1777902 ] [ 11.4367913 -4.8415887 -1.7808971 ] [ 4.8710306 -3.9121269 4.3806253 ] [ 0.6522293 -0.4616038 -0.3281108 ] [ 7.5946582 7.2930222 6.3053537 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.061053171755928e-08 -5.83701979206808e-09 7.153081004509667e-10 ] [ -2.009306523532291e-08 1.220248293984577e-08 -2.275286526155843e-08 ] [ -8.63738470245797e-09 -3.285603490334061e-09 8.295734474194185e-09 ] [ 1.832375978879448e-08 -7.757080286578436e-09 -2.853311721178361e-09 ] [ 7.804251410819e-09 -6.267918308422853e-09 7.018535497969239e-09 ] [ 1.044986544470176e-09 -7.39570822525609e-10 -5.256914571230472e-10 ] [ 1.21679839112565e-08 1.168470976008327e-08 1.010229036724545e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.051385 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.411497735633809e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3061988 1.7704691 2.7299616 ] [ 1.6759302 4.2390081 2.5077653 ] [ 1.5525062 3.2056221 4.7080091 ] [ 4.7455423 1.7007377 2.8340049 ] [ 3.7778414 2.2574081 4.996121 ] [ 3.9571052 3.758105 1.8012277 ] [ 3.520649 4.7398359 4.1927603 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3061988e-10 1.7704691e-10 2.7299616e-10 ] [ 1.6759302e-10 4.2390081e-10 2.5077653e-10 ] [ 1.5525062e-10 3.2056221e-10 4.7080091e-10 ] [ 4.7455423e-10 1.7007377e-10 2.8340049e-10 ] [ 3.7778414e-10 2.2574081e-10 4.996120999999999e-10 ] [ 3.9571052e-10 3.758105e-10 1.8012277e-10 ] [ 3.520649e-10 4.7398359e-10 4.1927603e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.9e-06 9.2e-05 -3.6e-06 ] [ 3.64e-05 1.75e-05 3.47e-05 ] [ 1.9e-06 -6.91e-05 -3.83e-05 ] [ 8.82e-05 -0.0001933 -5.67e-05 ] [ 4.4e-06 8.99e-05 -1.42e-05 ] [ -4.78e-05 -5.3e-05 -2.1e-06 ] [ -8.02e-05 0.0001161 8.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.6463122386e-15 1.47400250328e-13 -5.767835882399999e-15 ] [ 5.831922947759999e-14 2.8038091095e-14 5.55955291998e-14 ] [ 3.0441356046e-15 -1.107104054094e-13 -6.13633650822e-14 ] [ 1.413119791188e-13 -3.097007433522e-13 -9.08434151478e-14 ] [ 7.0495771896e-15 1.440356793966e-13 -2.27509082028e-14 ] [ -7.65840431052e-14 -8.491536160199999e-14 -3.364570931399999e-15 ] [ -1.284945660468e-13 1.860127072074e-13 1.286547837102e-13 ] ] } "relaxed-potential-energy" { "source-value" -22.095233 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.540046603538572e-18 } }