{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6341805 0.2307049 0.3334775 ] [ 0.1254928 -0.2842392 0.719448 ] [ 0.086338 0.0569654 -0.7064921 ] [ -0.8460114 -0.0034311 -0.3464334 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.016069170467254e-09 3.696299970840019e-10 5.34289854062832e-10 ] [ 2.010616302387302e-10 -4.554014009548954e-10 1.152682765481318e-09 ] [ 1.383287250866304e-10 9.126863207452032e-11 -1.131925125399896e-09 ] [ -1.355459686010277e-09 -5.49722820362688e-12 -5.550474941442547e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0757318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.132218823411102e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6317252 2.3069385 0.8210369 ] [ 1.6813513 4.3805122 1.0660019 ] [ 2.8564983 4.6892267 3.0119348 ] [ 3.8068712 2.6156516 2.76697 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6317252e-10 2.3069385e-10 8.210369e-11 ] [ 1.6813513e-10 4.3805122e-10 1.0660019e-10 ] [ 2.8564983e-10 4.6892267e-10 3.0119348e-10 ] [ 3.8068712e-10 2.6156516e-10 2.76697e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -6.1e-06 -4e-06 ] [ 8e-07 3e-06 2.6e-06 ] [ -4e-07 2e-07 5e-07 ] [ -4e-07 2.9e-06 9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -9.77327738688e-15 -6.4087064832e-15 ] [ 1.28174129664e-15 4.8065298624e-15 4.16565921408e-15 ] [ -6.408706483200001e-16 3.2043532416e-16 8.010883104e-16 ] [ -6.408706483200001e-16 4.646312200320001e-15 1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.5960346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.056801242610788e-18 } }