{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.18156 2.402287 4.241396 ] [ 0.8961477 3.559566 3.04631 ] [ 5.464384 2.707991 2.659357 ] [ 3.611912 1.298545 2.707748 ] [ 3.448769 3.905478 2.40265 ] [ 4.321729 3.291274 4.492065 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.18156e-10 2.402287e-10 4.241396e-10 ] [ 8.961477e-11 3.559566e-10 3.04631e-10 ] [ 5.464384e-10 2.707991e-10 2.659357e-10 ] [ 3.611912e-10 1.298545e-10 2.707748e-10 ] [ 3.448769e-10 3.905478e-10 2.40265e-10 ] [ 4.321729000000001e-10 3.291274e-10 4.492065e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9891558 -1.8266427 1.5052919 ] [ -0.9844846 2.2351248 -2.5208884 ] [ 2.5548404 -0.787968 -1.5551191 ] [ -0.128149 1.7882764 0.8477184 ] [ -3.0526346 -0.8875208 0.2129913 ] [ -0.3787279 -0.5212696 1.5100058 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.186978917888721e-09 -2.926604228494989e-09 2.411743489659612e-09 ] [ -1.57731820965764e-09 3.581064699130276e-09 -4.038908458125918e-09 ] [ 4.09330555875532e-09 -1.262463907538535e-09 -2.491575464579537e-09 ] [ -2.053173317788992e-10 2.865134639608389e-09 1.358194601501983e-09 ] [ -4.89085978796516e-09 -1.421965076233713e-09 3.41249681293799e-10 ] [ -6.067889870246803e-10 -8.351659662537676e-10 2.4192959900324e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.2251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.240418237334208e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1501022 2.8112654 4.6319853 ] [ 1.3058014 2.9739781 2.3684142 ] [ 5.2799027 2.865419 2.2451692 ] [ 3.2731127 1.6398872 2.7975924 ] [ 3.3458225 4.1294133 2.949419 ] [ 4.5697603 2.7451779 4.5569459 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1501022e-10 2.8112654e-10 4.6319853e-10 ] [ 1.3058014e-10 2.9739781e-10 2.3684142e-10 ] [ 5.2799027e-10 2.865419e-10 2.2451692e-10 ] [ 3.2731127e-10 1.6398872e-10 2.7975924e-10 ] [ 3.3458225e-10 4.129413300000001e-10 2.949419e-10 ] [ 4.569760300000001e-10 2.7451779e-10 4.5569459e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 1.22e-05 1.48e-05 ] [ -4.76e-05 -2.15e-05 -4.98e-05 ] [ -1.03e-05 1.21e-05 -3.51e-05 ] [ 9.1e-06 -2.67e-05 1.79e-05 ] [ 4.22e-05 3.89e-05 2.8e-05 ] [ 3.9e-06 -1.51e-05 2.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 1.954655477376e-14 2.371221398784e-14 ] [ -7.626360715008e-14 -3.44467973472e-14 -7.978839571583999e-14 ] [ -1.650241919424e-14 1.938633711168e-14 -5.623639939008e-14 ] [ 1.457980724928e-14 -4.277811577536e-14 2.867896151232001e-14 ] [ 6.761185339776e-14 6.232467054911999e-14 4.48609453824e-14 ] [ 6.24848882112e-15 -2.419286697408e-14 3.893289188544e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }