{ "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" [ [ 2.082752 2.058358 1.918508 ] [ 1.804708 3.969119 3.022657 ] [ 3.997636 1.573064 0.3548062 ] [ 3.986466 2.315414 3.180743 ] [ 3.658552 3.790773 1.50531 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.082752e-10 2.058358e-10 1.918508e-10 ] [ 1.804708e-10 3.969119e-10 3.022657e-10 ] [ 3.997636e-10 1.573064e-10 3.548062000000001e-11 ] [ 3.986466e-10 2.315414e-10 3.180743e-10 ] [ 3.658552e-10 3.790773e-10 1.50531e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.2782507 -19.0935268 -7.6666283 ] [ -7.0108349 11.8201781 9.083363 ] [ 1.423789 -1.7275234 -2.673826 ] [ 10.2017272 -7.0515328 13.9711591 ] [ 9.6635694 16.052405 -12.7140679 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.287627964593414e-08 -3.059120249961279e-08 -1.228329272382314e-08 ] [ -1.123259586161173e-08 1.893801316153851e-08 1.455315195674014e-08 ] [ 2.281161467546226e-09 -2.767797626168235e-09 -4.283941540581684e-09 ] [ 1.634496894628224e-08 -1.129780108604459e-08 2.238426465991647e-08 ] [ 1.54827450937174e-08 2.571878821050477e-08 -2.037018251246945e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.8181809 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.252610675836509e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0852016 1.4113362 2.0744992 ] [ 1.8435932 3.9631315 2.676383 ] [ 3.4839779 1.9841442 0.0464829 ] [ 3.9120389 2.4339464 3.6711292 ] [ 4.2053024 3.9141696 1.5135299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0852016e-10 1.4113362e-10 2.0744992e-10 ] [ 1.8435932e-10 3.9631315e-10 2.676383e-10 ] [ 3.4839779e-10 1.9841442e-10 4.648290000000001e-12 ] [ 3.9120389e-10 2.4339464e-10 3.6711292e-10 ] [ 4.2053024e-10 3.9141696e-10 1.5135299e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-06 -1.3e-06 -4.8e-06 ] [ 5.8e-06 -5.3e-06 4.5e-06 ] [ -1.3e-06 3e-07 2.1e-06 ] [ -4.3e-06 8.3e-06 -1.5e-06 ] [ 1.2e-06 -2e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.2430472876e-15 -2.0828296242e-15 -7.690447843199998e-15 ] [ 9.2926244772e-15 -8.4915361602e-15 7.209794853e-15 ] [ -2.0828296242e-15 4.806529901999999e-16 3.364570931399999e-15 ] [ -6.8893595262e-15 1.32980660622e-14 -2.403264951e-15 ] [ 1.9226119608e-15 -3.204353268e-15 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -15.879291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.544142900468649e-18 } }