{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.8894439 -7.6778815 -17.7904553 ] [ -7.7202551 -3.6845789 1.7399161 ] [ 12.5140435 -6.8824496 11.944391 ] [ -14.0177083 11.185723 -6.4220539 ] [ 14.0756573 1.1492434 -8.1309628 ] [ -1.2674032 -9.8441922 14.5821381 ] [ 9.3051098 15.7541359 4.0770268 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.065116584183383e-08 -1.230132233792087e-08 -2.850345178988146e-08 ] [ -1.236921232973933e-08 -5.903346219709422e-09 2.787652920540407e-09 ] [ 2.004970809255958e-08 -1.102689993380265e-08 1.913702416755989e-08 ] [ -2.245884470048786e-08 1.792150402499638e-08 -1.028926470086857e-08 ] [ 2.255168923425153e-08 1.841290922258715e-09 -1.302723861008321e-08 ] [ -2.030603792896828e-09 -1.577213472344505e-08 2.336316093758115e-08 ] [ 1.490842949836441e-08 2.524090842784055e-08 6.53211707515179e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.684939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.872133623551533e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5656932 2.4556165 1.1318296 ] [ 0.8691532 2.0850447 3.0549272 ] [ 3.6341346 3.4971326 4.8869091 ] [ 1.3978058 4.4016316 3.9106653 ] [ 5.1012947 2.3673931 2.0016737 ] [ 3.3118644 1.3275403 3.5944048 ] [ 3.5938672 4.5338303 2.4249503 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5656932e-10 2.4556165e-10 1.1318296e-10 ] [ 8.691532e-11 2.0850447e-10 3.0549272e-10 ] [ 3.6341346e-10 3.4971326e-10 4.8869091e-10 ] [ 1.3978058e-10 4.4016316e-10 3.9106653e-10 ] [ 5.101294700000001e-10 2.3673931e-10 2.0016737e-10 ] [ 3.3118644e-10 1.3275403e-10 3.5944048e-10 ] [ 3.5938672e-10 4.5338303e-10 2.4249503e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.57e-05 -4.4e-06 1.93e-05 ] [ -3.31e-05 2e-06 -9.5e-06 ] [ -1.17e-05 1.11e-05 1.46e-05 ] [ -1.3e-06 1.15e-05 2.22e-05 ] [ -5.08e-05 -1.47e-05 -1.11e-05 ] [ 4.23e-05 7e-07 -2.16e-05 ] [ -1.1e-06 -6.1e-06 -1.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.924123851379999e-14 -7.0495771896e-15 3.09220090362e-14 ] [ -5.303204658539999e-14 3.204353268e-15 -1.5220678023e-14 ] [ -1.87454666178e-14 1.77841606374e-14 2.33917788564e-14 ] [ -2.0828296242e-15 1.8425031291e-14 3.55683212748e-14 ] [ -8.13905730072e-14 -2.35519965198e-14 -1.77841606374e-14 ] [ 6.77720716182e-14 1.1215236438e-15 -3.46070152944e-14 ] [ -1.7623942974e-15 -9.773277467399999e-15 -2.22702552126e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.755005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.805971395155317e-18 } }