{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4336003 -4.8463565 -1.1012191 ] [ -0.696741 4.4914554 -0.9536616 ] [ 2.4863175 -2.2821164 0.5166462 ] [ -3.5083166 -3.661181 -0.3820637 ] [ 0.3401263 0.0188271 -1.453783 ] [ 0.0242393 5.2340958 1.7326757 ] [ 2.7879747 1.0452755 1.6414055 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.296880884231867e-09 -7.764719080362115e-09 -1.764347496398417e-09 ] [ -1.116302140952813e-09 7.196104835245913e-09 -1.527934319674721e-09 ] [ 3.983519770385904e-09 -3.656353542024261e-09 8.27758462865161e-10 ] [ -5.620942834884545e-09 -5.865858602717165e-09 -6.12133527796345e-10 ] [ 5.44942405979207e-10 3.016433945746368e-11 -2.329217134316487e-09 ] [ 3.883563976455744e-11 8.385945921787473e-09 2.776052497968275e-09 ] [ 4.466827883721893e-09 1.674715968395031e-09 2.629821517352534e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.820161 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.015322195389195e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6485518 2.3376194 2.7838219 ] [ 2.8521532 4.583455 3.3062457 ] [ 5.6336745 2.5799529 1.424167 ] [ 3.4390766 2.6010955 0.6325734 ] [ 4.8690249 1.9787904 3.5494333 ] [ 4.811683 4.759912 1.851964 ] [ 4.996209 4.1685849 4.2962667 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6485518e-10 2.3376194e-10 2.7838219e-10 ] [ 2.8521532e-10 4.583455e-10 3.3062457e-10 ] [ 5.6336745e-10 2.5799529e-10 1.424167e-10 ] [ 3.4390766e-10 2.6010955e-10 6.325734e-11 ] [ 4.869024900000001e-10 1.9787904e-10 3.5494333e-10 ] [ 4.811683000000001e-10 4.759912e-10 1.851964e-10 ] [ 4.996209000000001e-10 4.1685849e-10 4.2962667e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.69e-05 8.4e-06 4.42e-05 ] [ -2.26e-05 3.2e-06 -4.48e-05 ] [ -3.2e-05 2.05e-05 -1.87e-05 ] [ 4.47e-05 1.01e-05 -6.4e-06 ] [ 3.2e-05 -4.3e-06 4.24e-05 ] [ -7e-07 1.66e-05 6.3e-06 ] [ 1.54e-05 -5.45e-05 -2.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.912031730752001e-14 1.345828361472e-14 7.081620663936001e-14 ] [ -3.620919163008e-14 5.126965186560001e-15 -7.177751261183999e-14 ] [ -5.12696518656e-14 3.28446207264e-14 -2.996070280896e-14 ] [ 7.161729494976001e-14 1.618198387008e-14 -1.025393037312e-14 ] [ 5.12696518656e-14 -6.889359469440001e-15 6.793228872192001e-14 ] [ -1.12152363456e-15 2.659613190528e-14 1.009371271104e-14 ] [ 2.467351996032e-14 -8.731862583360001e-14 -3.68500622784e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.30335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573390593551968e-18 } }