{ "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" [ [ 0.1779892 2.357943 0.2667025 ] [ 0.683577 1.802827 2.30843 ] [ 1.994264 0.9284256 0.4445094 ] [ 2.959137 1.015728 2.327469 ] [ 2.670153 2.85418 1.122954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.779892e-11 2.357943e-10 2.667025e-11 ] [ 6.83577e-11 1.802827e-10 2.30843e-10 ] [ 1.994264e-10 9.284256e-11 4.445094e-11 ] [ 2.959137e-10 1.015728e-10 2.327469e-10 ] [ 2.670153e-10 2.85418e-10 1.122954e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.9882218 2.4149732 -4.8588727 ] [ -10.0658298 0.266081 10.6770634 ] [ 1.7146592 -9.9184994 -11.3393063 ] [ 6.5247043 -4.8567372 7.5584029 ] [ 8.8146881 12.0941823 -2.0372873 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.119636558892489e-08 3.869213600898562e-09 -7.784772243383373e-09 ] [ -1.612723717451194e-08 4.263087574390848e-10 1.710654135827936e-08 ] [ 2.747186882879632e-09 -1.589118785209883e-08 -1.816757144995015e-08 ] [ 1.045372868709323e-08 -7.781350795209654e-09 1.210989641696692e-08 ] [ 1.412268719346397e-08 1.937701612875317e-08 -3.264094081912756e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.9705632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.759366909648835e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5542647 2.4589073 0.3254644 ] [ 0.4307061 1.668408 2.7030981 ] [ 1.8968826 0.3553797 0.0688573 ] [ 2.8397841 1.1247328 2.2625628 ] [ 2.7634827 3.3516758 1.1100822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.542647000000001e-11 2.4589073e-10 3.254644e-11 ] [ 4.307061e-11 1.668408e-10 2.7030981e-10 ] [ 1.8968826e-10 3.553797000000001e-11 6.88573e-12 ] [ 2.8397841e-10 1.1247328e-10 2.2625628e-10 ] [ 2.7634827e-10 3.3516758e-10 1.1100822e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.5e-06 -6e-07 3.6e-06 ] [ 9.1e-06 -2.1e-06 -4e-06 ] [ 1.7e-06 4.2e-06 9.1e-06 ] [ -1.3e-05 6e-06 -1.05e-05 ] [ -4.2e-06 -7.6e-06 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.04141480352e-14 -9.6130597248e-16 5.76783583488e-15 ] [ 1.457980724928e-14 -3.36457090368e-15 -6.4087064832e-15 ] [ 2.72370025536e-15 6.72914180736e-15 1.457980724928e-14 ] [ -2.08282960704e-14 9.6130597248e-15 -1.68228545184e-14 ] [ -6.72914180736e-15 -1.217654231808e-14 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }