{ "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" [ [ 0.223645 0.1945873 1.126976 ] [ 0.7288277 2.388611 0.0814776 ] [ 2.404153 0.5300895 0.5572584 ] [ 2.145602 0.6403931 2.690423 ] [ 2.26761 2.998114 1.480003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.23645e-11 1.945873e-11 1.126976e-10 ] [ 7.288277e-11 2.388611e-10 8.14776e-12 ] [ 2.404153e-10 5.300895e-11 5.572584000000001e-11 ] [ 2.145602e-10 6.403931000000001e-11 2.690423e-10 ] [ 2.26761e-10 2.998114e-10 1.480003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.8729884 -6.5553273 -0.6061678 ] [ -8.5772076 8.5884775 -7.4836298 ] [ 13.9928419 -12.3476195 -10.7629176 ] [ 4.5813496 -2.3590691 14.4133296 ] [ 3.8760044 12.6735383 4.4393855 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.22269776751096e-08 -1.050279214175199e-08 -9.711878774417704e-10 ] [ -1.374220148846808e-08 1.376025785876683e-08 -1.199009670428218e-08 ] [ 2.241900415073065e-08 -1.978306728543419e-08 -1.724409495031685e-08 ] [ 7.340131220831432e-09 -3.779645358871697e-09 2.309269971300462e-08 ] [ 6.210043631797931e-09 2.030524676707338e-08 7.112679658818519e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.5258298 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.04682545367994e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3246766 0.3228755 -0.0111924 ] [ 0.201783 2.6263846 0.4480124 ] [ 2.1464069 -0.5606855 1.185781 ] [ 3.1494084 1.1967513 2.3847511 ] [ 1.9475628 3.1664689 1.9287859 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.246766e-11 3.228755e-11 -1.11924e-12 ] [ 2.01783e-11 2.626384600000001e-10 4.480124e-11 ] [ 2.1464069e-10 -5.606855e-11 1.185781e-10 ] [ 3.1494084e-10 1.1967513e-10 2.3847511e-10 ] [ 1.9475628e-10 3.1664689e-10 1.9287859e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 4.2e-06 3.9e-06 ] [ 7e-07 1.9e-06 9e-07 ] [ 2.9e-06 -1.4e-05 -1.5e-06 ] [ -3.6e-06 -3e-07 -2.6e-06 ] [ -3.3e-06 8.1e-06 -7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 6.72914180736e-15 6.24848882112e-15 ] [ 1.12152363456e-15 3.04413557952e-15 1.44195895872e-15 ] [ 4.646312200320001e-15 -2.24304726912e-14 -2.4032649312e-15 ] [ -5.76783583488e-15 -4.8065298624e-16 -4.16565921408e-15 ] [ -5.28718284864e-15 1.297763062848e-14 -1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }