{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.5456511 -1.1177341 0.9828885 ] [ -0.2402147 -0.0849618 1.2353505 ] [ 2.4083996 -3.8019673 -2.9800102 ] [ -0.4089634 6.1073229 4.0882755 ] [ -3.7273498 -2.7663453 6.3436763 ] [ -2.9502399 5.3369203 -9.5968755 ] [ 1.3727171 -3.6732347 -0.0733051 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.680759297933803e-09 -1.790807443290929e-09 1.574760975553181e-09 ] [ -3.848663763124858e-10 -1.361238096210854e-10 1.97924968959359e-09 ] [ 3.858681532664072e-09 -6.0914231211061e-09 -4.774502672185532e-09 ] [ -6.552315982428788e-10 9.785009966056456e-09 6.55013942548943e-09 ] [ -5.971872707103555e-09 -4.432173764719962e-09 1.016368985778305e-08 ] [ -4.72680539353133e-09 8.550688931732923e-09 -1.537588955882831e-08 ] [ 2.199335244592376e-09 -5.885170759051302e-09 -1.174477174054061e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.286274 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.64804277179429e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9600266 1.120302 1.8975642 ] [ 0.7081056 2.3123592 3.2593208 ] [ 3.4049679 4.1124238 2.9393534 ] [ 3.9420134 0.2100365 2.2427552 ] [ 3.9423196 3.746958 0.8357198 ] [ 4.6257401 0.9479166 4.2093761 ] [ 3.8029118 2.9158202 4.7497824 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9600266e-10 1.120302e-10 1.8975642e-10 ] [ 7.081056e-11 2.3123592e-10 3.2593208e-10 ] [ 3.4049679e-10 4.1124238e-10 2.9393534e-10 ] [ 3.9420134e-10 2.100365e-11 2.2427552e-10 ] [ 3.9423196e-10 3.746958e-10 8.357198000000001e-11 ] [ 4.6257401e-10 9.479166e-11 4.2093761e-10 ] [ 3.8029118e-10 2.9158202e-10 4.7497824e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.4091364 -0.3200225 -0.0533958 ] [ -0.2589449 0.0864359 -0.1282747 ] [ 0.1118155 -0.0922167 0.2199724 ] [ -0.351323 0.1190387 0.2763823 ] [ -0.1360171 0.2400561 -0.0042472 ] [ 0.3221799 -0.7899551 -0.2310197 ] [ -0.0968469 0.7566637 -0.0794174 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.555087747982771e-10 -5.12732567629968e-10 -8.554950240891264e-11 ] [ -4.148754648553939e-10 1.384855781778067e-10 -2.055187253801338e-10 ] [ 1.791481799430624e-10 -1.477474407873274e-10 3.52434636501266e-10 ] [ -5.628814969493185e-10 1.90721022110425e-10 4.428132594629319e-10 ] [ -2.179234176490157e-10 3.846122711004269e-10 -6.804764543861759e-12 ] [ 5.16189103471682e-10 -1.265647592701726e-09 -3.701343622842298e-10 ] [ -1.551658389769555e-10 1.212308889948025e-09 -1.272407015647219e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.063194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.413389726137484e-18 } }