{ "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" [ [ -21.0246934 -9.5334521 -24.6492962 ] [ -11.7014963 -4.1301066 8.3417533 ] [ -15.8042607 27.3716323 23.4088411 ] [ 41.7777151 -32.0108417 11.5115216 ] [ 6.7527353 18.3027681 -18.6128197 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.368527222496806e-08 -1.527427407013666e-08 -3.949252609081428e-08 ] [ -1.874786380023771e-08 -6.617160235931777e-09 1.336496211374125e-08 ] [ -2.532121700256824e-08 4.385418934419414e-08 3.750509793044216e-08 ] [ 6.693527840366313e-08 -5.128702218386972e-08 1.844349077735421e-08 ] [ 1.081907462411088e-08 2.932426714574404e-08 -2.982102457050567e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 26.168867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.192714690022463e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3841087 -0.2584889 0.7838161 ] [ 0.5301513 -0.0272486 2.5362249 ] [ 1.9299646 3.6049982 2.8937267 ] [ 2.4898594 0.371148 2.6154423 ] [ 2.3357228 4.4519815 1.2828315 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.841087e-11 -2.584889e-11 7.838161e-11 ] [ 5.301513e-11 -2.72486e-12 2.5362249e-10 ] [ 1.9299646e-10 3.6049982e-10 2.8937267e-10 ] [ 2.4898594e-10 3.71148e-11 2.6154423e-10 ] [ 2.3357228e-10 4.4519815e-10 1.2828315e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.8759766 0.1761761 -0.0365903 ] [ -0.4006233 -1.0431292 0.7676725 ] [ 0.5591901 0.075235 0.0945165 ] [ -1.0531501 0.7693168 -0.7589891 ] [ 0.0186067 0.0224012 -0.0666096 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.403469228887873e-09 2.822652285637229e-10 -5.862412320805824e-11 ] [ -6.418692850077447e-10 -1.671277216713808e-09 1.229946931931088e-09 ] [ 8.959213048028141e-10 1.20539758065888e-10 1.514321265798432e-10 ] [ -1.687332468413182e-09 1.23258139094867e-09 -1.216034591462033e-09 ] [ 2.981121973023937e-11 3.589067891786496e-11 -1.067203438408397e-10 ] ] } "relaxed-potential-energy" { "source-value" -25.695252 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.116833201996444e-18 } }