{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3958104 -1.7541253 -1.5949461 ] [ -0.0728415 0.1160687 1.314729 ] [ 0.1121761 0.7067646 -0.1165249 ] [ -1.3246922 1.513319 -0.0364704 ] [ 0.8895472 -0.582027 0.4332124 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.341581743741936e-10 -2.81041856876824e-09 -2.555385373909427e-09 ] [ -1.16704949285511e-10 1.859625590787558e-10 2.106428083842186e-09 ] [ 1.797259263132474e-10 1.132361727858356e-09 -1.866934720591866e-10 ] [ -2.122390890082055e-09 2.424604341588245e-09 -5.84320227126336e-11 ] [ 1.425211738680125e-09 -9.325100597571178e-10 6.940827848390615e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.512896432689672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.684351702011734e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9475607 1.6884733 2.2041198 ] [ 1.8388395 2.114697 4.5457771 ] [ 2.4917123 4.0081021 2.195168 ] [ 4.2671744 1.5380251 2.7271858 ] [ 3.7842611 3.4187335 4.1079733 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9475607e-10 1.6884733e-10 2.2041198e-10 ] [ 1.8388395e-10 2.114697e-10 4.5457771e-10 ] [ 2.4917123e-10 4.0081021e-10 2.195168e-10 ] [ 4.2671744e-10 1.5380251e-10 2.7271858e-10 ] [ 3.7842611e-10 3.4187335e-10 4.107973300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-06 2.09e-05 4e-07 ] [ 2.83e-05 -1.37e-05 -9.8e-06 ] [ 2.6e-06 -1.9e-06 4.2e-06 ] [ -1.03e-05 -9.3e-06 2.33e-05 ] [ -1.92e-05 4e-06 -1.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.0828296242e-15 3.34854916506e-14 6.408706536e-16 ] [ 4.53415987422e-14 -2.19498198858e-14 -1.57013310132e-14 ] [ 4.165659248399999e-15 -3.0441356046e-15 6.729141862799999e-15 ] [ -1.65024193302e-14 -1.49002426962e-14 3.733071557219999e-14 ] [ -3.076179137279999e-14 6.408706535999999e-15 -2.915961473879999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }