{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0788263 -0.5267758 3.1078718 ] [ 5.5237275 -0.5113248 -3.6282583 ] [ -0.8657151 4.4569574 -3.1610915 ] [ -0.2358384 -3.8500005 -1.829268 ] [ -3.3433477 0.4311437 5.5107461 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.728470275764167e-09 -8.439878711632167e-10 4.979359538403613e-09 ] [ 8.849987060170032e-09 -8.192326401952359e-10 -5.813110622483553e-09 ] [ -1.387028493493534e-09 7.140832946181555e-09 -5.064626897509604e-09 ] [ -3.778547707668787e-10 -6.168380791168311e-09 -2.930810422777574e-09 ] [ -5.356633520145451e-09 6.90768356345209e-10 8.82918856458478e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7504266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.611022437346434e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1611536 2.5660998 0.6938071 ] [ 2.1182955 3.0223543 3.151411 ] [ 2.4296987 0.420775 1.1030981 ] [ 2.0161638 4.7586552 0.5774919 ] [ 4.1058053 2.9464455 2.218112 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1611536e-10 2.5660998e-10 6.938071e-11 ] [ 2.1182955e-10 3.0223543e-10 3.151411e-10 ] [ 2.4296987e-10 4.20775e-11 1.1030981e-10 ] [ 2.0161638e-10 4.7586552e-10 5.774919e-11 ] [ 4.1058053e-10 2.9464455e-10 2.218112e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0010971 -0.0074234 0.0019307 ] [ 0.0004783 0.0002282 0.0010968 ] [ -0.0010971 0.0032478 -0.0022303 ] [ -0.0009232 0.0037432 -0.0017745 ] [ 0.0004448 0.0002042 0.0009773 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.75774797067968e-12 -1.189359792684672e-11 3.09332240177856e-12 ] [ 7.663210777286401e-13 3.6561670486656e-13 1.75726731769344e-12 ] [ -1.75774797067968e-12 5.203549229034241e-12 -3.57333451737024e-12 ] [ -1.47912945632256e-12 5.99726752697856e-12 -2.8430624136096e-12 ] [ 7.1264816093184e-13 3.2716446596736e-13 1.56580721150784e-12 ] ] } "relaxed-potential-energy" { "source-value" -8.5391827 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.368127888267982e-18 } }