{ "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" [ [ 0.5231689 0.1640524 1.493785 ] [ 2.625554 0.0718253 0.0473088 ] [ 2.391634 1.372958 2.83206 ] [ 1.806242 1.946446 0.9821647 ] [ 1.54049 2.8226 2.60214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.231689000000001e-11 1.640524e-11 1.493785e-10 ] [ 2.625554e-10 7.18253e-12 4.73088e-12 ] [ 2.391634e-10 1.372958e-10 2.83206e-10 ] [ 1.806242e-10 1.946446e-10 9.821647e-11 ] [ 1.54049e-10 2.8226e-10 2.60214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.87974 -1.3283236 -0.2359205 ] [ 0.4974145 -0.3976605 -0.4269799 ] [ 7.4757739 -11.4558495 7.2210066 ] [ -0.8655895 -1.0442731 -11.6556226 ] [ -6.2278589 14.2261067 5.0975164 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.409498860382592e-09 -2.128209016776891e-09 -3.779863094674464e-10 ] [ 7.969458827469216e-10 -6.371223561156384e-10 -6.84097213331522e-10 ] [ 1.197751016496684e-08 -1.835429424030337e-08 1.15693279531625e-08 ] [ -1.386827260109962e-09 -1.673109946550341e-09 -1.867436603058811e-08 ] [ -9.978129927221207e-09 2.279273555974624e-08 8.167121600224582e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.2598638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.222877567352248e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0121872 -0.0165237 1.5903329 ] [ 2.7264029 0.3124602 -0.107741 ] [ 1.8430362 0.9287898 3.5183978 ] [ 1.2419101 2.1472876 0.4921934 ] [ 2.0635526 3.0058678 2.4642755 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0121872e-10 -1.65237e-12 1.5903329e-10 ] [ 2.7264029e-10 3.124602000000001e-11 -1.07741e-11 ] [ 1.8430362e-10 9.287898e-11 3.5183978e-10 ] [ 1.2419101e-10 2.1472876e-10 4.921934e-11 ] [ 2.0635526e-10 3.0058678e-10 2.4642755e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.6e-06 -2.6e-06 2.7e-06 ] [ 1.9e-06 1.7e-06 -2.7e-06 ] [ 1.2e-06 -2e-07 3e-07 ] [ 2.5e-06 -3e-07 0.0 ] [ -1e-06 1.4e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.370012455680001e-15 -4.16565921408e-15 4.32587687616e-15 ] [ 3.04413557952e-15 2.72370025536e-15 -4.32587687616e-15 ] [ 1.92261194496e-15 -3.2043532416e-16 4.8065298624e-16 ] [ 4.005441552e-15 -4.8065298624e-16 0.0 ] [ -1.6021766208e-15 2.24304726912e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.457994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.675555348726667e-18 } }