{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7095629 -2.8174528 -8.2612601 ] [ -2.7161297 0.1098059 2.3976584 ] [ -5.7379866 8.1337385 9.4836216 ] [ 12.1746022 -10.7166636 3.8033495 ] [ 1.9890769 5.290572 -7.4233693 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.147728193367048e-09 -4.514057006367498e-09 -1.323599779056787e-08 ] [ -4.351719504400519e-09 1.759284458059027e-10 3.841472233144735e-09 ] [ -9.193267980983681e-09 1.303168566440086e-08 1.519443680803389e-08 ] [ 1.950586301238025e-08 -1.716998787289837e-08 6.09363764963137e-09 ] [ 3.186852506153339e-09 8.476430769059098e-09 -1.189354874002446e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.146341 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946058357846449e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8498719 0.7153883 0.6113763 ] [ 0.1449182 0.7871492 2.9562549 ] [ 1.3811854 2.8794128 3.2638884 ] [ 2.4394651 0.9527922 2.3615101 ] [ 2.0861488 2.8076476 0.9190118 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.498719e-11 7.153883e-11 6.113763e-11 ] [ 1.449182e-11 7.871492e-11 2.9562549e-10 ] [ 1.3811854e-10 2.8794128e-10 3.2638884e-10 ] [ 2.4394651e-10 9.527922e-11 2.3615101e-10 ] [ 2.0861488e-10 2.8076476e-10 9.190118000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.92e-05 3.9e-06 1.38e-05 ] [ -2.17e-05 3.6e-06 -3.4e-06 ] [ 1e-06 1.71e-05 4.1e-06 ] [ 1.72e-05 -1.26e-05 -2.68e-05 ] [ -1.58e-05 -1.2e-05 1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.076179111936e-14 6.24848882112e-15 2.211003736704e-14 ] [ -3.476723267136e-14 5.76783583488e-15 -5.44740051072e-15 ] [ 1.6021766208e-15 2.739722021568e-14 6.568924145279999e-15 ] [ 2.755743787776e-14 -2.018742542208e-14 -4.293833343744e-14 ] [ -2.531439060864e-14 -1.92261194496e-14 1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.80656 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333578399127245e-18 } }