{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.2499933 -5.7949288 -9.1956598 ] [ -7.6589026 -13.120729 12.9249308 ] [ -2.9657595 13.6370342 -11.655392 ] [ -6.9510473 12.5388021 11.6949362 ] [ 7.6054227 -14.1223955 -10.4829929 ] [ 13.4762078 -0.1680995 12.7546999 ] [ 12.7440723 7.0303165 -6.0405223 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.603535935341664e-08 -9.284499442560599e-09 -1.47330711443904e-08 ] [ -1.227091468670433e-08 -2.102172525165257e-08 2.070802195321784e-08 ] [ -4.751670533815498e-09 2.184893737229003e-08 -1.867399656865936e-08 ] [ -1.113680547413496e-08 2.008937557745794e-08 1.873735336138759e-08 ] [ 1.218523044124161e-08 -2.262657189979113e-08 -1.679560614039239e-08 ] [ 2.15912650742026e-08 -2.693250888681696e-10 2.04352819851001e-08 ] [ 2.041825469284489e-08 1.126380873312448e-08 -9.677983606481045e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 141.48293 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.26680642688283e-17 } "relaxed-configuration-positions" { "source-value" [ [ -3.9668105 0.3455609 -0.1516261 ] [ -0.1946381 -2.8031121 8.5579416 ] [ 0.8206355 8.9182133 -2.0463527 ] [ -0.0467363 7.3911756 7.8521688 ] [ 5.6665071 -2.6556815 -0.0841648 ] [ 8.5124822 2.095871 8.9892399 ] [ 10.2436282 6.3574089 0.1099143 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.9668105e-10 3.455609e-11 -1.516261e-11 ] [ -1.946381e-11 -2.8031121e-10 8.5579416e-10 ] [ 8.206354999999999e-11 8.9182133e-10 -2.0463527e-10 ] [ -4.67363e-12 7.3911756e-10 7.852168800000001e-10 ] [ 5.6665071e-10 -2.6556815e-10 -8.41648e-12 ] [ 8.512482200000002e-10 2.095871e-10 8.989239899999999e-10 ] [ 1.02436282e-09 6.357408900000001e-10 1.099143e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }