{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8488176 -7.3360186 -15.3180377 ] [ 3.5185374 -8.9720229 15.450477 ] [ -14.8044911 -6.6693071 1.7868865 ] [ -6.6754761 16.1356174 1.3301161 ] [ 17.1126122 6.8417312 -3.2494419 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.359955714043566e-09 -1.175359749067395e-08 -2.4542201879473e-08 ] [ 5.637318361690418e-09 -1.437476533166222e-08 2.475439302960812e-08 ] [ -2.371940952326168e-08 -1.068540791255545e-08 2.862907774323139e-09 ] [ -1.069529174012916e-08 2.585210896045368e-08 2.131080918369675e-09 ] [ 2.741742718765686e-08 1.096166177443793e-08 -5.206179842827931e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 84.655323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.356327793368725e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.3689667 0.1394518 -2.507715 ] [ 3.790837 -0.0422266 8.8848738 ] [ -5.0447789 0.0098068 4.201947 ] [ -0.3651643 8.8446338 3.9184511 ] [ 9.0145737 5.6516512 2.5372391 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3689667e-10 1.394518e-11 -2.507715e-10 ] [ 3.790837e-10 -4.22266e-12 8.8848738e-10 ] [ -5.0447789e-10 9.8068e-13 4.201947e-10 ] [ -3.651643e-11 8.8446338e-10 3.9184511e-10 ] [ 9.0145737e-10 5.6516512e-10 2.5372391e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }