{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -26.5193147 7.3856128 -28.9541908 ] [ 0.271966 -7.5906827 39.2924235 ] [ 16.4486161 -8.842959 -12.0928636 ] [ -16.688967 33.080437 -25.4344975 ] [ 26.4876996 -24.032408 27.1891285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.248862601197776e-08 1.183305615844123e-08 -4.638972757394245e-08 ] [ 4.357375668524928e-10 -1.216161435785102e-08 6.295340230627251e-08 ] [ 2.635358815993447e-08 -1.416798216849295e-08 -1.937490333844333e-08 ] [ -2.673867275270272e-08 5.300070276724729e-08 -4.075055725629605e-08 ] [ 4.243797303789351e-08 -3.850416223912689e-08 4.356178602262697e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.351946 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.459652896498408e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5168836 0.4200824 1.3841374 ] [ -0.3546256 0.6581298 3.3907761 ] [ 1.7192484 0.0075154 -0.4115769 ] [ 1.6696403 2.6378499 1.2518408 ] [ 2.8145634 1.2989069 2.5634741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.168836e-11 4.200824e-11 1.3841374e-10 ] [ -3.546256e-11 6.581298e-11 3.3907761e-10 ] [ 1.7192484e-10 7.5154e-13 -4.115769e-11 ] [ 1.6696403e-10 2.6378499e-10 1.2518408e-10 ] [ 2.8145634e-10 1.2989069e-10 2.5634741e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0362003 0.010412 0.0772928 ] [ 0.0089706 -0.0016492 -0.0299141 ] [ 0.0272297 -0.0087627 -0.0473787 ] [ -0.0041604 0.0048654 -0.0047662 ] [ 0.0041604 -0.0048654 0.0047662 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.799927432594624e-11 1.66818629757696e-11 1.238367171161702e-10 ] [ 1.437248559454848e-11 -2.64230968302336e-12 -4.792767165227328e-11 ] [ 4.362678873139776e-11 -1.403939307508416e-11 -7.590904546389696e-11 ] [ -6.66569561317632e-12 7.79523013084032e-12 -7.636294210056961e-12 ] [ 6.66569561317632e-12 -7.79523013084032e-12 7.636294210056961e-12 ] ] } "relaxed-potential-energy" { "source-value" -8.5388667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.368077259486765e-18 } }