{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6992635 -0.7918221 -6.619318 ] [ -5.7419983 -2.9579331 2.4507403 ] [ -4.5415247 4.3888862 0.5417899 ] [ 0.18054 -7.1350501 -1.6699881 ] [ 6.6988158 3.0632291 -3.1847858 ] [ 2.7390568 -0.8767028 4.9975503 ] [ 2.3643738 4.3093927 3.4840113 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.722520252278781e-09 -1.26863885645276e-09 -1.060531654524061e-08 ] [ -9.199695432933344e-09 -4.739131258710468e-09 3.926518812312378e-09 ] [ -7.276324697125734e-09 7.031770860991753e-09 8.6804311116557e-10 ] [ 2.89256967119232e-10 -1.14316104584567e-08 -2.675615890834213e-09 ] [ 1.073268606180565e-08 4.907834048174226e-09 -5.102589351015824e-09 ] [ 4.388452768003261e-09 -1.404632729549898e-09 8.006958251932027e-09 ] [ 3.788144425192055e-09 6.904408233786188e-09 5.582001451463016e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.255916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.604484856488865e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0238717 2.0212067 0.8839289 ] [ 1.9426278 0.8898413 3.8870629 ] [ 1.8520446 3.0383832 2.7545436 ] [ 3.5712436 -0.0188752 2.2217694 ] [ 5.2080784 2.0933139 2.0985937 ] [ 4.3539689 1.1996399 4.4708493 ] [ 4.0147561 3.563765 3.7311152 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0238717e-10 2.0212067e-10 8.839289e-11 ] [ 1.9426278e-10 8.898412999999999e-11 3.8870629e-10 ] [ 1.8520446e-10 3.0383832e-10 2.7545436e-10 ] [ 3.5712436e-10 -1.88752e-12 2.2217694e-10 ] [ 5.2080784e-10 2.0933139e-10 2.0985937e-10 ] [ 4.3539689e-10 1.1996399e-10 4.470849300000001e-10 ] [ 4.0147561e-10 3.563765e-10 3.7311152e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.2e-06 -1.21e-05 4.8e-06 ] [ 1.07e-05 6.7e-06 -1.1e-05 ] [ 6e-06 1.4e-06 9e-06 ] [ -9.5e-06 6.7e-06 1e-06 ] [ -9.5e-06 1.19e-05 -1.5e-06 ] [ -2.1e-06 1.6e-06 4.2e-06 ] [ -4.8e-06 -1.61e-05 -6.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.474002491136e-14 -1.938633711168e-14 7.69044777984e-15 ] [ 1.714328984256e-14 1.073458335936e-14 -1.76239428288e-14 ] [ 9.6130597248e-15 2.24304726912e-15 1.44195895872e-14 ] [ -1.52206778976e-14 1.073458335936e-14 1.6021766208e-15 ] [ -1.52206778976e-14 1.906590178752e-14 -2.4032649312e-15 ] [ -3.36457090368e-15 2.56348259328e-15 6.72914180736e-15 ] [ -7.69044777984e-15 -2.579504359488e-14 -1.04141480352e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }