{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.4967853e-10 -1.4158748e-10 1.6081832e-10 ] [ -9.971434000000001e-11 3.6544661e-10 3.6798976e-10 ] [ 3.1606098e-10 -9.733884000000001e-11 -1.2836807e-10 ] [ 3.5184956e-10 -1.5126924e-10 4.3116182e-10 ] [ 1.0293807e-10 4.1601701e-10 -1.4911325e-10 ] [ 4.6358289e-10 3.6012292e-10 2.6236108e-10 ] ] "source-value" [ [ -1.4967853 -1.4158748 1.6081832 ] [ -0.9971434 3.6544661 3.6798976 ] [ 3.1606098 -0.9733884 -1.2836807 ] [ 3.5184956 -1.5126924 4.3116182 ] [ 1.0293807 4.1601701 -1.4911325 ] [ 4.6358289 3.6012292 2.6236108 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -1.6021766208e-16 0.0 ] [ -1.6021766208e-16 0.0 -1.6021766208e-16 ] [ 1.6021766208e-16 1.6021766208e-16 1.6021766208e-16 ] ] "source-value" [ [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ -0.0 -1e-07 0.0 ] [ -1e-07 0.0 -1e-07 ] [ 1e-07 1e-07 1e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 6.261282201437088e-33 "source-value" 3.907985e-14 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.904084662908861e-08 -2.016275783017318e-08 -5.772177733522368e-10 ] [ -1.741359610439075e-08 1.733765133038821e-08 1.410169531516059e-08 ] [ 7.316209442141591e-09 -1.609903117553808e-08 -2.065495481940136e-08 ] [ 1.221117000116769e-08 -1.532202918736688e-08 1.780364087575932e-08 ] [ -2.280351868905721e-09 1.871069634677072e-08 -1.864542270993336e-08 ] [ 1.92074151590758e-08 1.553547051591921e-08 7.97225911176705e-09 ] ] "source-value" [ [ -11.8843618 -12.5846037 -0.360271 ] [ -10.8687119 10.8213109 8.801586 ] [ 4.5664188 -10.048225 -12.8918089 ] [ 7.6216129 -9.5632585 11.1121587 ] [ -1.4232837 11.6782982 -11.6375576 ] [ 11.9883257 9.6964781 4.9758928 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.030632891863262e-17 "source-value" 64.327046 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.279875e-11 3.441096000000001e-11 1.620821e-10 ] [ 6.388481e-12 2.12081e-10 2.259282e-10 ] [ 2.131638e-10 2.823527e-12 4.91309e-11 ] [ 2.985428e-10 1.085719e-11 2.760683e-10 ] [ 1.598201e-10 2.879516e-10 4.111126e-11 ] [ 2.843247e-10 2.032667e-10 1.905289e-10 ] ] "source-value" [ [ 0.2279875 0.3441096 1.620821 ] [ 0.06388481 2.12081 2.259282 ] [ 2.131638 0.02823527 0.491309 ] [ 2.985428 0.1085719 2.760683 ] [ 1.598201 2.879516 0.4111126 ] [ 2.843247 2.032667 1.905289 ] ] } "instance-id" 1 }