{ "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" [ [ -6.8992287 -5.5471989 0.45223 ] [ -4.4842344 6.4154203 0.4119295 ] [ 5.3686277 -2.485727 -0.8325926 ] [ -5.0058456 -4.5537628 -5.8487655 ] [ 2.7692262 -3.9675032 1.1143704 ] [ 2.2639286 7.946534 -1.931147 ] [ 5.9875263 2.1922376 6.6339752 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.105378292469238e-08 -8.887592388507478e-09 7.24552333224384e-10 ] [ -7.184535517867116e-09 1.027863641726572e-08 6.599838143178336e-10 ] [ 8.601489786719277e-09 -3.982573685091322e-09 -1.333960398371086e-09 ] [ -8.02024878765455e-09 -7.295932294828747e-09 -9.370755344641622e-09 ] [ 4.436789475346825e-09 -6.356640869989187e-09 1.785418201791544e-09 ] [ 3.627213474080475e-09 1.273175099119231e-08 -3.094038574728058e-09 ] [ 9.593074654285127e-09 3.512351829958702e-09 1.062879996840701e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.5303457 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.258413964681811e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5819317 2.4263783 2.7990888 ] [ 3.1772756 4.735613 3.2689593 ] [ 5.5304862 2.7885793 1.3070216 ] [ 3.3531256 2.1466922 0.5520286 ] [ 4.9612218 1.9410671 3.5127964 ] [ 4.8200034 5.0256212 1.5931505 ] [ 4.8263286 3.9454589 4.8114268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5819317e-10 2.4263783e-10 2.7990888e-10 ] [ 3.1772756e-10 4.735613e-10 3.2689593e-10 ] [ 5.5304862e-10 2.7885793e-10 1.3070216e-10 ] [ 3.3531256e-10 2.1466922e-10 5.520286e-11 ] [ 4.9612218e-10 1.9410671e-10 3.5127964e-10 ] [ 4.820003400000001e-10 5.0256212e-10 1.5931505e-10 ] [ 4.8263286e-10 3.9454589e-10 4.8114268e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.91e-05 1.4e-06 2.8e-06 ] [ -8.3e-06 -7.8e-06 -3.6e-06 ] [ -1.82e-05 -6.6e-06 6.4e-06 ] [ 4.6e-06 1.08e-05 2.45e-05 ] [ 2.5e-06 -3e-07 -2.05e-05 ] [ 1.56e-05 2.8e-06 -4.4e-06 ] [ -1.52e-05 -3e-07 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.060157345728e-14 2.24304726912e-15 4.48609453824e-15 ] [ -1.329806595264e-14 -1.249697764224e-14 -5.76783583488e-15 ] [ -2.915961449856e-14 -1.057436569728e-14 1.025393037312e-14 ] [ 7.370012455680001e-15 1.730350750464e-14 3.92533272096e-14 ] [ 4.005441552e-15 -4.8065298624e-16 -3.28446207264e-14 ] [ 2.499395528448e-14 4.48609453824e-15 -7.04957713152e-15 ] [ -2.435308463616e-14 -4.8065298624e-16 -8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }