{ "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" [ [ 0.6678483 0.3705928 0.1642866 ] [ 0.4651457 2.25942 0.9775642 ] [ 2.325854 0.8972553 0.6909246 ] [ 2.51877 2.867173 0.7641457 ] [ 2.596702 2.283556 2.674442 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.678483e-11 3.705928e-11 1.642866e-11 ] [ 4.651457e-11 2.25942e-10 9.775642000000001e-11 ] [ 2.325854e-10 8.972553e-11 6.909246e-11 ] [ 2.51877e-10 2.867173e-10 7.641457000000001e-11 ] [ 2.596702e-10 2.283556e-10 2.674442e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.1865822 -14.4977779 -8.5871126 ] [ -16.8209514 9.15692 1.9392222 ] [ 13.489765 -12.9680622 -2.7662298 ] [ 9.7124645 16.3220919 -8.2571365 ] [ 5.8053041 1.9868282 17.6712568 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.952505708829743e-08 -2.322800080493092e-08 -1.37580710478971e-08 ] [ -2.695013507269303e-08 1.467100314253594e-08 3.106976471376341e-09 ] [ 2.161298610308612e-08 -2.077712607392022e-08 -4.43198871332026e-09 ] [ 1.556108355224996e-08 2.615087404472905e-08 -1.322939105505434e-08 ] [ 9.301122505654384e-09 3.183249691586146e-09 2.831247450511302e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 93.701456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.501262821381199e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.7920302 -3.5537816 -2.3093535 ] [ -4.1975588 5.3530989 2.014067 ] [ 6.9390973 -2.7638617 -0.1457496 ] [ 4.9044087 6.8863455 -1.8339942 ] [ 3.720403 2.7561961 7.5463934 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.7920302e-10 -3.5537816e-10 -2.3093535e-10 ] [ -4.197558800000001e-10 5.3530989e-10 2.014067e-10 ] [ 6.939097300000001e-10 -2.7638617e-10 -1.457496e-11 ] [ 4.904408700000001e-10 6.8863455e-10 -1.8339942e-10 ] [ 3.720403e-10 2.7561961e-10 7.5463934e-10 ] ] } "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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }