{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.9960942 -12.6657868 4.5527455 ] [ -3.2886608 12.5412423 -4.1190828 ] [ -13.7894121 -28.6943498 -28.7903952 ] [ 16.741503 25.7421462 27.8104402 ] [ -0.6595243 3.0767481 0.5462923 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 1.595918839354479e-09 -2.029282749499725e-08 7.294302400552406e-09 ] [ -5.269015447501426e-09 2.009328520884802e-08 -6.599498161299402e-09 ] [ -2.209307368119663e-08 -4.597341639861716e-08 -4.612729809303254e-08 ] [ 2.682284470365307e-08 4.124346481085556e-08 4.455723710259647e-08 ] [ -1.056674414309485e-09 4.929493873910821e-09 8.752567511830598e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 4.4229397 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.086330582548166e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1515051 0.6129927 0.4125648 ] [ -1.5203859 1.1851588 3.161789 ] [ 0.0761159 2.6757414 2.8995705 ] [ 3.9542657 -0.8104397 1.3473565 ] [ 3.7144422 1.3486902 1.7060819 ] [ 2.1967584 2.8211317 2.3232361 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ -1.5203859e-10 1.1851588e-10 3.161789000000001e-10 ] [ 7.61159e-12 2.6757414e-10 2.8995705e-10 ] [ 3.9542657e-10 -8.104397e-11 1.3473565e-10 ] [ 3.7144422e-10 1.3486902e-10 1.7060819e-10 ] [ 2.1967584e-10 2.8211317e-10 2.3232361e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.1894618 0.0222659 0.0558728 ] [ 0.2016017 0.0544423 -0.0484896 ] [ 0.1249469 0.1861774 -0.0091292 ] [ -0.1276284 -0.0752297 0.0230958 ] [ -0.0094585 -0.1876559 -0.0213497 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ -3.035512664946855e-10 3.567390442107072e-11 8.951809389863424e-11 ] [ 3.230015304535353e-10 8.722618024257985e-11 -7.768890347194368e-11 ] [ 2.001870020214355e-10 2.982890776013299e-10 -1.462659080660736e-11 ] [ -2.044832386301107e-10 -1.205312665297978e-10 3.700355079867264e-11 ] [ -1.51541875678368e-11 -3.006578957351827e-10 -3.420599020109376e-11 ] ] } "relaxed-potential-energy" { "source-value" -10.952766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.754826561829313e-18 } }