{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9468439 -0.2907822 -1.1145653 ] [ -0.4017299 -8.8679854 4.5482806 ] [ -9.2860334 2.0539541 -4.178545 ] [ -1.7476743 -1.7112464 -7.5776498 ] [ 1.2664495 1.7368119 7.0947891 ] [ 3.9676759 1.3899664 -6.1016149 ] [ 5.2544683 5.6892816 7.3293052 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.517011160127093e-09 -4.658844425847898e-10 -1.785730466014938e-09 ] [ -6.436422536563219e-10 -1.420807888147574e-08 7.287148842158196e-09 ] [ -1.487786561344794e-08 3.290797239216305e-09 -6.694767107960737e-09 ] [ -2.800082904233005e-09 -2.741718974508165e-09 -1.21407333501698e-08 ] [ 2.029075780323849e-09 2.782679420907228e-09 1.136710522552667e-08 ] [ 6.356917565891599e-09 2.226971669777541e-09 -9.775864741904931e-09 ] [ 8.41858626499472e-09 9.115233968667617e-09 1.174284143814787e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.410161 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.629197629776395e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6844491 2.1294332 1.5955968 ] [ 2.9174194 1.9594777 3.9107906 ] [ 2.1118095 4.2582609 2.4622007 ] [ 4.8849548 2.8981775 1.4232939 ] [ 4.9607463 3.0241748 3.79475 ] [ 4.1837895 5.1032153 1.2996889 ] [ 4.0329164 5.1423805 3.6923791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6844491e-10 2.1294332e-10 1.5955968e-10 ] [ 2.9174194e-10 1.9594777e-10 3.9107906e-10 ] [ 2.1118095e-10 4.2582609e-10 2.4622007e-10 ] [ 4.8849548e-10 2.8981775e-10 1.4232939e-10 ] [ 4.960746300000001e-10 3.0241748e-10 3.79475e-10 ] [ 4.1837895e-10 5.103215299999999e-10 1.2996889e-10 ] [ 4.032916400000001e-10 5.1423805e-10 3.6923791e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.94e-05 2.61e-05 8.77e-05 ] [ -1.58e-05 7.56e-05 -6.42e-05 ] [ 3.4e-05 -9.02e-05 -4.34e-05 ] [ -3.67e-05 -2.22e-05 -4.49e-05 ] [ 5e-06 -3.59e-05 -2.4e-06 ] [ -8.6e-06 1.48e-05 8.5e-06 ] [ -7.3e-06 3.18e-05 5.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.710399265152e-14 4.181680980288e-14 1.4051088964416e-13 ] [ -2.531439060864e-14 1.2112455253248e-13 -1.0285973905536e-13 ] [ 5.44740051072e-14 -1.4451633119616e-13 -6.953446534272e-14 ] [ -5.879988198335999e-14 -3.556832098176e-14 -7.193773027392e-14 ] [ 8.010883104e-15 -5.751814068672e-14 -3.84522388992e-15 ] [ -1.377871893888e-14 2.371221398784e-14 1.36185012768e-14 ] [ -1.169588933184e-14 5.094921654144e-14 9.404776764096e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.30335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573390593551968e-18 } }