{ "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" [ [ 0.7826629 0.079664 0.3147899 ] [ 0.4004832 1.295186 0.8087518 ] [ 0.7320587 0.6290848 2.788823 ] [ 1.344916 2.662801 0.2560168 ] [ 0.3963272 2.667865 2.000738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.826629000000001e-11 7.9664e-12 3.147899e-11 ] [ 4.004832e-11 1.295186e-10 8.087518e-11 ] [ 7.320586999999999e-11 6.290848000000001e-11 2.788823e-10 ] [ 1.344916e-10 2.662801e-10 2.560168e-11 ] [ 3.963272e-11 2.667865e-10 2.000738e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2490.0927852 -7913.1371412 -3213.5131433 ] [ -2643.4949726 7577.9049673 3194.2858638 ] [ 1.5844 -3.1472225 3.3588699 ] [ 169.0845667 217.6000938 -119.9916549 ] [ -17.2667793 120.7793026 135.8600645 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.989568444070196e-06 -1.267824332481479e-05 -5.14861562882878e-06 ] [ -4.235345842302057e-06 1.214114217325225e-05 5.117810131132293e-06 ] [ 2.53848863799552e-09 -5.042406309955728e-09 5.381502826088834e-09 ] [ 2.709033397048382e-07 3.48633782970247e-07 -1.922478241718818e-07 ] [ -2.766443011097339e-08 1.935097749022487e-07 2.1767181904228e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 985.92638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.579628195865977e-16 } "relaxed-configuration-positions" { "source-value" [ [ 1.1128074 0.0013407 0.2505921 ] [ -0.4784891 1.4391886 0.805739 ] [ 1.0483387 0.8319349 2.3033374 ] [ 1.6240155 2.1296377 0.5923935 ] [ 0.3497756 2.9324989 2.2170575 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1128074e-10 1.3407e-13 2.505921e-11 ] [ -4.784891e-11 1.4391886e-10 8.05739e-11 ] [ 1.0483387e-10 8.319349000000001e-11 2.3033374e-10 ] [ 1.6240155e-10 2.1296377e-10 5.923935000000001e-11 ] [ 3.497756000000001e-11 2.9324989e-10 2.2170575e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.74e-05 -3.46e-05 -6.92e-05 ] [ 4.99e-05 -8.9e-06 5.3e-06 ] [ 4.85e-05 -5.7e-05 5.64e-05 ] [ 4.9e-05 -1.41e-05 -2.74e-05 ] [ -0.0001 0.0001146 3.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.594317182591999e-14 -5.543531107968001e-14 -1.1087062215936e-13 ] [ 7.994861337792e-14 -1.425937192512e-14 8.491536090240001e-15 ] [ 7.77055661088e-14 -9.13240673856e-14 9.036276141312001e-14 ] [ 7.85066544192e-14 -2.259069035328e-14 -4.389963940992e-14 ] [ -1.6021766208e-13 1.8360944074368e-13 5.6076181728e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }