{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0113291 0.6173253 -0.664478 ] [ -4.9599891 -1.3652247 6.7206668 ] [ 9.9139398 -1.1268211 -2.204424 ] [ 4.5175007 3.5284576 0.0434417 ] [ -7.4601223 -1.6537371 -3.8952065 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.222504487304249e-09 9.890641712370402e-10 -1.064611125407052e-09 ] [ -7.946778640914688e-09 -2.187331114499659e-09 1.076769531185955e-08 ] [ 1.588388269844263e-08 -1.805366437118177e-09 -3.531876624228816e-09 ] [ 7.237834065618644e-09 5.653212320779718e-09 6.96012766812378e-11 ] [ -1.195243363584234e-08 -2.649578940398922e-09 -6.24080883890492e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8159898 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.092041959514233e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7978627 0.9187599 -0.0005779 ] [ 1.1070787 2.1597543 2.1437257 ] [ 3.0701234 1.0571184 1.0247995 ] [ 2.4806694 4.0704628 2.4973111 ] [ 4.3232319 3.0354976 1.4470494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.978627000000001e-11 9.187599e-11 -5.779e-14 ] [ 1.1070787e-10 2.1597543e-10 2.1437257e-10 ] [ 3.0701234e-10 1.0571184e-10 1.0247995e-10 ] [ 2.4806694e-10 4.0704628e-10 2.4973111e-10 ] [ 4.3232319e-10 3.0354976e-10 1.4470494e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.23e-05 -3.5e-05 6.7e-06 ] [ -3.1e-06 4.6e-05 -5.6e-06 ] [ 1.71e-05 8.5e-06 -2.82e-05 ] [ -2.19e-05 -1.54e-05 1.61e-05 ] [ 3.02e-05 -4.1e-06 1.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.572853893819999e-14 -5.607618218999999e-14 1.07345834478e-14 ] [ -4.9667475654e-15 7.370012516399999e-14 -8.972189150399999e-15 ] [ 2.73972204414e-14 1.3618501389e-14 -4.51813810788e-14 ] [ -3.50876682846e-14 -2.46735201636e-14 2.579504380739999e-14 ] [ 4.838573434679999e-14 -6.568924199399999e-15 1.74637253106e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.146626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.785886372513688e-18 } }