{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1164533 -3.9163546 0.9243764 ] [ -5.2893074 1.9859921 -4.6727889 ] [ -2.9494828 6.7702019 7.3071733 ] [ 9.7545142 -9.6099883 -10.1246668 ] [ 3.1268149 -2.3128557 14.9127936 ] [ 0.4739145 7.0830046 -8.3468876 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.197461858675008e-09 -6.274691778882536e-09 1.481014256899269e-09 ] [ -8.474404656504435e-09 3.181910111713496e-09 -7.48663312951375e-09 ] [ -4.725592385611723e-09 1.084705920227574e-08 1.170738222539398e-08 ] [ 1.562845459850161e-08 -1.539689858042153e-08 -1.622150444034995e-08 ] [ 5.00970973034909e-09 -3.705603329824019e-09 2.389292925673587e-08 ] [ 7.592947321581217e-10 1.134822437513886e-08 -1.337318816916542e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.86762438 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.390087497272095e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.727005 1.5185383 2.1646479 ] [ -0.0586581 1.6609663 -0.149266 ] [ 1.3448333 2.5398058 2.8720597 ] [ 3.6848091 0.9699868 0.889436 ] [ 3.016482 0.8275584 3.2033547 ] [ 2.037684 2.6874623 0.4732841 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.270050000000001e-11 1.5185383e-10 2.1646479e-10 ] [ -5.86581e-12 1.6609663e-10 -1.49266e-11 ] [ 1.3448333e-10 2.5398058e-10 2.8720597e-10 ] [ 3.6848091e-10 9.699868e-11 8.89436e-11 ] [ 3.016482e-10 8.275584000000001e-11 3.2033547e-10 ] [ 2.037684e-10 2.6874623e-10 4.732841e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 -4.5e-06 -7.9e-06 ] [ -3.47e-05 -1.02e-05 -1.69e-05 ] [ 3.75e-05 -4.8e-06 1.3e-06 ] [ 7.4e-06 8e-07 9.5e-06 ] [ -1.46e-05 6.8e-06 2e-06 ] [ 4.9e-06 1.19e-05 1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 -7.2097947936e-15 -1.265719530432e-14 ] [ -5.559552874176001e-14 -1.634220153216e-14 -2.707678489152e-14 ] [ 6.008162327999999e-14 -7.69044777984e-15 2.08282960704e-15 ] [ 1.185610699392e-14 1.28174129664e-15 1.52206778976e-14 ] [ -2.339177866368e-14 1.089480102144e-14 3.2043532416e-15 ] [ 7.850665441919999e-15 1.906590178752e-14 1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9523637 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.434326782103859e-18 } }