{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0221122 0.00357 0.1110342 ] [ 0.2725629 2.182164 0.260904 ] [ 0.3472204 2.881652 2.59775 ] [ 1.734388 0.2655593 2.566686 ] [ 2.338795 2.363947 0.0295877 ] [ 1.600298 1.908592 1.497057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.21122e-12 3.57e-13 1.110342e-11 ] [ 2.725629e-11 2.182164e-10 2.60904e-11 ] [ 3.472204e-11 2.881652e-10 2.59775e-10 ] [ 1.734388e-10 2.655593e-11 2.566686e-10 ] [ 2.338795e-10 2.363947e-10 2.95877e-12 ] [ 1.600298e-10 1.908592e-10 1.497057e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.9703607 -1.9350854 4.0201806 ] [ -16.3525645 5.3543866 -10.1145575 ] [ -5.9550364 2.8070835 6.3707974 ] [ -3.3828036 -6.5556259 2.3354337 ] [ 17.9573238 8.4767036 -26.8687134 ] [ 4.7627201 -8.1474626 24.2568592 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.759042468883123e-09 -3.100348587131416e-09 6.441039368713716e-09 ] [ -2.619969653202404e-08 8.5786730292448e-09 -1.62053075562373e-08 ] [ -9.541020096092997e-09 4.497443556333437e-09 1.020714265013343e-08 ] [ -5.419848840678075e-09 -1.050327055169096e-08 3.741777273568441e-09 ] [ 2.877080436449542e-08 1.358117632937119e-08 -4.304842444045568e-08 ] [ 7.630718795634239e-09 -1.305367409656238e-08 3.88637727042774e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.090671499715841e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8111603 -0.0961872 0.4607913 ] [ 0.1160724 2.1239764 0.3348234 ] [ 0.4209188 2.6312134 2.5882464 ] [ 0.6984639 0.3190509 2.7555667 ] [ 2.0794663 3.0433386 -0.4836572 ] [ 2.1892947 1.5840921 1.4072483 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.111603e-11 -9.618720000000001e-12 4.607913000000001e-11 ] [ 1.160724e-11 2.1239764e-10 3.348234e-11 ] [ 4.209188e-11 2.6312134e-10 2.5882464e-10 ] [ 6.984639000000001e-11 3.190509000000001e-11 2.7555667e-10 ] [ 2.0794663e-10 3.0433386e-10 -4.836572e-11 ] [ 2.1892947e-10 1.5840921e-10 1.4072483e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 5.1e-06 1.04e-05 ] [ 7.5e-06 -7.7e-06 -5.7e-06 ] [ 4.6e-06 -2.03e-05 1.16e-05 ] [ 1.1e-06 2.96e-05 -2.16e-05 ] [ -5.3e-06 4e-07 -2e-07 ] [ -7.4e-06 -7.2e-06 5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 8.17110076608e-15 1.666263685632e-14 ] [ 1.2016324656e-14 -1.233675998016e-14 -9.13240673856e-15 ] [ 7.370012455680001e-15 -3.252418540224e-14 1.858524880128e-14 ] [ 1.76239428288e-15 4.742442797568e-14 -3.460701500928e-14 ] [ -8.491536090240001e-15 6.408706483200001e-16 -3.2043532416e-16 ] [ -1.185610699392e-14 -1.153567166976e-14 8.972189076479999e-15 ] ] } "relaxed-potential-energy" { "source-value" -23.138023 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.707119950213268e-18 } }