{ "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" [ [ 0.1688646 -3.0895155 -0.2448398 ] [ 0.4896582 2.2779739 -0.5546358 ] [ 0.3934019 -1.4300774 0.7040585 ] [ -1.55228 -1.9492955 -0.2917525 ] [ -0.0056299 -0.0782645 -1.1059836 ] [ 0.1711007 3.327938 0.7417628 ] [ 0.3348845 0.9412409 0.7513903 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.705509142007437e-10 -4.949949503699223e-09 -3.922766034013478e-10 ] [ 7.845189202230106e-10 3.649716525372598e-09 -8.886245118187047e-10 ] [ 6.302993267582995e-10 -2.29123657621445e-09 1.128026068375517e-09 ] [ -2.487026724935424e-09 -3.123115677130647e-09 -4.67439034559952e-10 ] [ -9.020094157441922e-12 -1.253935521386016e-10 -1.771981066908219e-09 ] [ 2.741335413425146e-10 5.331944459071911e-09 1.188435016339146e-09 ] [ 5.365441165682975e-10 1.508034164520751e-09 1.203859971755898e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.646374 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.147696110629299e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6817463 2.0472078 2.9166596 ] [ 2.8185895 4.4360573 2.9503038 ] [ 5.5991272 2.4992387 1.4203121 ] [ 3.3601751 3.1809092 0.9214334 ] [ 4.9493282 1.8785147 3.6263196 ] [ 4.9749947 4.7701801 1.8442802 ] [ 4.866412 4.1973023 4.1651634 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6817463e-10 2.0472078e-10 2.9166596e-10 ] [ 2.8185895e-10 4.4360573e-10 2.9503038e-10 ] [ 5.5991272e-10 2.4992387e-10 1.4203121e-10 ] [ 3.3601751e-10 3.1809092e-10 9.214334e-11 ] [ 4.9493282e-10 1.8785147e-10 3.6263196e-10 ] [ 4.9749947e-10 4.7701801e-10 1.8442802e-10 ] [ 4.866412000000001e-10 4.1973023e-10 4.1651634e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.67e-05 -2.03e-05 -1.07e-05 ] [ -1.62e-05 9.7e-06 8.3e-06 ] [ 7.4e-06 -3.6e-06 -3.5e-06 ] [ 3.3e-06 1e-05 -1.9e-06 ] [ 4.5e-06 -7e-06 1.08e-05 ] [ 1e-07 -3.7e-06 -7.9e-06 ] [ 1.76e-05 1.48e-05 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.675634956736e-14 -3.252418540224e-14 -1.714328984256e-14 ] [ -2.595526125696e-14 1.554111322176e-14 1.329806595264e-14 ] [ 1.185610699392e-14 -5.76783583488e-15 -5.6076181728e-15 ] [ 5.28718284864e-15 1.6021766208e-14 -3.04413557952e-15 ] [ 7.2097947936e-15 -1.12152363456e-14 1.730350750464e-14 ] [ 1.6021766208e-16 -5.928053496960001e-15 -1.265719530432e-14 ] [ 2.819830852608e-14 2.371221398784e-14 7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319314854257e-18 } }