{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.9926891 337.8456303 -742.1968103 ] [ 210.2040483 -397.0910645 745.5870698 ] [ -31.537878 -10.6373901 13.1218152 ] [ -142.1052672 49.1895402 -100.4099487 ] [ -43.5535921 20.6932842 83.8978741 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.120352299254299e-08 5.412883703061001e-07 -1.189130377494993e-06 ] [ 3.36784011783774e-07 -6.362100198704848e-07 1.194562172004338e-06 ] [ -5.052925080124267e-08 -1.704297772454937e-08 2.102346553589808e-08 ] [ -2.276777368003771e-07 7.881033129634177e-08 -1.608744723028674e-07 ] [ -6.978054701447957e-08 3.315429615281003e-08 1.344192124178418e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 237.89869 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.811557192369468e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.1095405 3.1278869 0.127541 ] [ 0.2357148 1.7721195 2.6983662 ] [ 1.7914392 -0.0043709 0.9992575 ] [ 2.9039827 2.3944714 -0.2135781 ] [ 2.8085682 3.1263695 2.6003852 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.095405e-11 3.1278869e-10 1.27541e-11 ] [ 2.357148e-11 1.7721195e-10 2.6983662e-10 ] [ 1.7914392e-10 -4.3709e-13 9.992575e-11 ] [ 2.9039827e-10 2.3944714e-10 -2.135781e-11 ] [ 2.8085682e-10 3.1263695e-10 2.6003852e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 0.0 -1e-07 ] [ 1.3e-06 9e-07 -1.5e-06 ] [ -1e-07 -2.2e-06 -9e-07 ] [ -2e-06 1e-07 2.1e-06 ] [ 6e-07 1.2e-06 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 0.0 -1.6021766208e-16 ] [ 2.08282960704e-15 1.44195895872e-15 -2.4032649312e-15 ] [ -1.6021766208e-16 -3.52478856576e-15 -1.44195895872e-15 ] [ -3.2043532416e-15 1.6021766208e-16 3.36457090368e-15 ] [ 9.6130597248e-16 1.92261194496e-15 8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.147671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946271447337016e-18 } }