{ "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" [ [ 1.02058 1.85993 1.630827 ] [ 2.141944 2.227969 3.994537 ] [ 1.553014 3.937737 2.507181 ] [ 3.345417 1.636187 2.240659 ] [ 3.907909 3.941805 1.929299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.02058e-10 1.85993e-10 1.630827e-10 ] [ 2.141944e-10 2.227969e-10 3.994537e-10 ] [ 1.553014e-10 3.937737e-10 2.507181e-10 ] [ 3.345417e-10 1.636187e-10 2.240659e-10 ] [ 3.907909e-10 3.941805e-10 1.929299e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.3537456 -7.427994 -8.5686912 ] [ -1.9984261 -3.7370327 16.2065408 ] [ -8.2398297 13.5438058 0.184131 ] [ 10.6373625 -11.4092074 -3.7780305 ] [ 10.9546389 9.0304284 -4.0439501 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.819070575883087e-08 -1.190095832624268e-08 -1.37285567114947e-08 ] [ -3.201831575816523e-09 -5.9873864231051e-09 2.596574077380133e-08 ] [ -1.320166250471348e-08 2.169956900941544e-08 2.950103833645248e-10 ] [ 1.704293350447464e-08 -1.827956535813835e-08 -6.053072139769335e-09 ] [ 1.755126633488623e-08 1.446834125828835e-08 -6.479122305901822e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 78.58174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.259018266497842e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.5830875 -0.5298132 -1.1003857 ] [ 1.6541551 1.2206037 8.711629 ] [ -1.8063399 8.6096434 2.8829545 ] [ 6.881403 -2.8187449 1.1765017 ] [ 7.8227333 7.121939 0.6318035 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.5830875e-10 -5.298132e-11 -1.1003857e-10 ] [ 1.6541551e-10 1.2206037e-10 8.711629e-10 ] [ -1.8063399e-10 8.6096434e-10 2.8829545e-10 ] [ 6.881403e-10 -2.8187449e-10 1.1765017e-10 ] [ 7.822733300000001e-10 7.121939e-10 6.318035e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }