{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8424147 0.1806209 1.2880187 ] [ 4.020373 -1.0787998 0.2429983 ] [ 2.3170902 2.3020985 2.2755712 ] [ 0.0976459 0.613608 -0.3766357 ] [ -0.5742118 0.1443758 -0.8449306 ] [ -0.9242649 0.7276397 -1.3537633 ] [ -3.0942177 -2.8895432 -1.2312586 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.951873758158246e-09 2.893865832078547e-10 2.063633448293209e-09 ] [ 6.441347627495558e-09 -1.728427818083716e-09 3.893261951541446e-10 ] [ 3.712387746724796e-09 3.688368395478749e-09 3.645866975605801e-09 ] [ 1.564459780969747e-10 9.831083919358464e-10 -6.034369130986426e-10 ] [ -9.199887213474856e-10 2.313155313692967e-10 -1.353728053518516e-09 ] [ -1.48083561420605e-09 1.165807315705926e-09 -2.168967909357056e-09 ] [ -4.957483258605548e-09 -4.629558559831619e-09 -1.972693743078939e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.161793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.87114598612091e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9666361 1.6713825 0.993978 ] [ 2.7748419 3.8272308 1.8150638 ] [ 4.914015 2.7397838 1.9289268 ] [ 3.4611149 1.2465883 3.2374722 ] [ 5.8190907 1.1207391 3.4584051 ] [ 4.6038789 2.9253903 4.3667902 ] [ 4.4910065 4.8267892 3.0132567 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9666361e-10 1.6713825e-10 9.939780000000001e-11 ] [ 2.7748419e-10 3.8272308e-10 1.8150638e-10 ] [ 4.914015e-10 2.7397838e-10 1.9289268e-10 ] [ 3.4611149e-10 1.2465883e-10 3.2374722e-10 ] [ 5.8190907e-10 1.1207391e-10 3.4584051e-10 ] [ 4.6038789e-10 2.9253903e-10 4.3667902e-10 ] [ 4.4910065e-10 4.826789200000001e-10 3.0132567e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1382683 0.0290671 0.0145919 ] [ -0.0329415 0.1806398 -0.0585203 ] [ -0.0687917 0.0040641 -0.0729179 ] [ 0.0420997 -0.2830306 0.1119926 ] [ -0.1386385 -0.0106068 -0.0261552 ] [ 0.0894711 0.0739906 0.0568966 ] [ -0.0294675 0.0058758 -0.0258877 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.215302376577607e-10 4.657062805445568e-11 2.337880103305152e-11 ] [ -5.27781011540832e-11 2.894168643459879e-10 -9.375985650220224e-11 ] [ -1.102164534450874e-10 6.511406004593281e-12 -1.168273546178323e-10 ] [ 6.745115508269376e-11 -4.534650102909965e-10 1.794319254226061e-10 ] [ -2.221233634427808e-10 -1.699396698150144e-11 -4.190524995234816e-11 ] [ 1.433485046572589e-10 1.185460094789645e-10 9.115840232300928e-11 ] [ -4.7212139573424e-11 9.41406938849664e-12 -4.147666770628416e-11 ] ] } "relaxed-potential-energy" { "source-value" -28.231544 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.523191976588651e-18 } }