{ "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" [ [ 0.5094065 0.6220131 0.2703167 ] [ 0.4530106 0.160144 2.650194 ] [ 0.6482707 2.949508 2.588273 ] [ 2.962565 0.672996 2.425796 ] [ 1.742585 2.553059 0.6145101 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.094065e-11 6.220131e-11 2.703167e-11 ] [ 4.530106e-11 1.60144e-11 2.650194e-10 ] [ 6.482707e-11 2.949508e-10 2.588273e-10 ] [ 2.962565e-10 6.72996e-11 2.425796e-10 ] [ 1.742585e-10 2.553059e-10 6.145100999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1478112 0.0035808 0.8470873 ] [ 2.1580793 6.9860507 -1.3165946 ] [ -0.3308976 -6.3285208 0.2267533 ] [ -2.7600649 1.3905462 -1.4059131 ] [ 0.785072 -2.051657 1.648667 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.36819648932393e-10 5.73707404376064e-12 1.357183467836596e-09 ] [ 3.457624200292429e-09 1.119288710326348e-08 -2.109417087191528e-09 ] [ -5.301563985988301e-10 -1.013940807000651e-08 3.632988359492486e-10 ] [ -4.422111454670691e-09 2.227900611782281e-09 -2.252521099696453e-09 ] [ 1.257824004044698e-09 -3.287116879300665e-09 2.641455722884474e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.460538 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.836180604538999e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4170907 0.6229846 0.2705868 ] [ 0.5946884 0.4327774 2.6147833 ] [ 0.4702942 2.788065 2.6036856 ] [ 2.9021182 0.7635818 2.2551811 ] [ 1.9316464 2.3503113 0.804853 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.170907e-11 6.229846e-11 2.705868e-11 ] [ 5.946884e-11 4.327774e-11 2.6147833e-10 ] [ 4.702942e-11 2.788065e-10 2.6036856e-10 ] [ 2.9021182e-10 7.635818e-11 2.2551811e-10 ] [ 1.9316464e-10 2.3503113e-10 8.048530000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-06 -1e-07 -1.2e-06 ] [ -9e-06 -1.47e-05 1.42e-05 ] [ 4e-07 -6e-07 -3e-07 ] [ -1.1e-06 1.1e-06 4e-07 ] [ 1.11e-05 1.42e-05 -1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4032649312e-15 -1.6021766208e-16 -1.92261194496e-15 ] [ -1.44195895872e-14 -2.355199632576e-14 2.275090801536e-14 ] [ 6.408706483200001e-16 -9.6130597248e-16 -4.8065298624e-16 ] [ -1.76239428288e-15 1.76239428288e-15 6.408706483200001e-16 ] [ 1.778416049088e-14 2.275090801536e-14 -2.098851373248e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.855922 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.219963428802838e-18 } }