{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.2980248 9.7361032 0.0958061 ] [ 4.8183792 -2.3847071 -4.0744359 ] [ -10.4831346 -14.6113336 -3.5686036 ] [ 3.9717398 -4.4810665 1.595101 ] [ 1.6868186 3.1582636 -11.0775881 ] [ 13.7846949 10.247778 5.7308429 ] [ -3.4804731 -1.6650376 11.2988775 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.64992545749786e-08 1.559895692473607e-08 1.534982935500269e-10 ] [ 7.719894504389007e-09 -3.820721963075768e-09 -6.527965941928207e-09 ] [ -1.679583316881956e-08 -2.34099370926295e-08 -5.717533256822715e-09 ] [ 6.363428651460868e-09 -7.179459982550083e-09 2.555633530014701e-09 ] [ 2.702581324450587e-09 5.060096102243643e-09 -1.774825266867229e-08 ] [ 2.208551589364099e-08 1.641875032674858e-08 9.181822511857671e-09 ] [ -5.576332630143301e-09 -2.667684315472942e-09 1.810279737178315e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9704491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.11678905844964e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.5567628 5.8111488 2.6589183 ] [ 5.7640937 3.4732651 0.8033703 ] [ 3.3257713 2.4422338 2.8899861 ] [ 5.744946 2.7463372 3.0867719 ] [ 3.4489389 4.0430413 1.0444854 ] [ 5.3359851 4.8063404 4.2414706 ] [ 2.8320422 4.1369434 4.5211524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.5567628e-10 5.8111488e-10 2.6589183e-10 ] [ 5.764093700000001e-10 3.4732651e-10 8.033703e-11 ] [ 3.3257713e-10 2.4422338e-10 2.8899861e-10 ] [ 5.744946e-10 2.7463372e-10 3.0867719e-10 ] [ 3.4489389e-10 4.0430413e-10 1.0444854e-10 ] [ 5.335985100000001e-10 4.8063404e-10 4.241470600000001e-10 ] [ 2.8320422e-10 4.1369434e-10 4.5211524e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.2e-05 -2.43e-05 -4.3e-06 ] [ 4.63e-05 3.4e-05 -5.04e-05 ] [ -2.09e-05 -1.75e-05 4.63e-05 ] [ 2.21e-05 -3.03e-05 8.8e-06 ] [ -4.13e-05 1.43e-05 2.4e-05 ] [ -4.12e-05 -2.8e-06 1.28e-05 ] [ 1.3e-05 2.65e-05 -3.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.52478856576e-14 -3.893289188544e-14 -6.889359469440001e-15 ] [ 7.418077754303999e-14 5.44740051072e-14 -8.074970168832e-14 ] [ -3.348549137472e-14 -2.8038090864e-14 7.418077754303999e-14 ] [ 3.540810331968e-14 -4.854595161024e-14 1.409915426304e-14 ] [ -6.616989443904001e-14 2.291112567744e-14 3.84522388992e-14 ] [ -6.600967677696001e-14 -4.48609453824e-15 2.050786074624e-14 ] [ 2.08282960704e-14 4.24576804512e-14 -5.960097029376001e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }