{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 13.6807741 -25.7916011 -67.4666559 ] [ -37.7667383 28.194068 55.152245 ] [ 1.2187706 -2.6112766 -0.9211499 ] [ 1.162976 -2.5793698 0.6342231 ] [ 21.7042176 2.7881795 12.6013377 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.191901641746616e-08 -4.132270029541956e-08 -1.080934987665384e-07 ] [ -6.050898514813193e-08 4.517187659484541e-08 8.83636375236337e-08 ] [ 1.952685761438389e-09 -4.183726318962113e-09 -1.475844834032258e-09 ] [ 1.863292957751501e-09 -4.132605989957572e-09 1.016137423191301e-09 ] [ 3.477399001147589e-08 4.467156009493834e-09 2.018956865374564e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.334973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.617151184199924e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5871022 2.2239395 -0.3385954 ] [ -0.1950215 2.7294339 1.9135989 ] [ 1.8487987 0.1888886 0.1829251 ] [ 2.3113098 0.6369026 2.5473838 ] [ 2.1483859 3.0674889 2.4743732 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.871022000000001e-11 2.2239395e-10 -3.385954e-11 ] [ -1.950215e-11 2.7294339e-10 1.9135989e-10 ] [ 1.8487987e-10 1.888886e-11 1.829251e-11 ] [ 2.3113098e-10 6.369026e-11 2.5473838e-10 ] [ 2.1483859e-10 3.0674889e-10 2.4743732e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 -3e-07 3e-07 ] [ 2.5e-06 -2e-07 -1.5e-06 ] [ 1.8e-06 5e-07 -0.0 ] [ -1.8e-06 -3e-07 2e-07 ] [ 5e-07 3e-07 1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 -4.8065298624e-16 4.8065298624e-16 ] [ 4.005441552e-15 -3.2043532416e-16 -2.4032649312e-15 ] [ 2.88391791744e-15 8.010883104e-16 0.0 ] [ -2.88391791744e-15 -4.8065298624e-16 3.2043532416e-16 ] [ 8.010883104e-16 4.8065298624e-16 1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.242001 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.801167117321022e-18 } }