{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0499796 0.1395341 -0.0505779 ] [ 0.1013875 0.3931874 0.2202197 ] [ 0.0835138 -0.0949393 -0.0038723 ] [ -0.1800185 -0.1345662 -0.358111 ] [ 0.0786823 -0.0583097 -0.1929506 ] [ 0.1701641 -0.1380162 -0.0319862 ] [ -0.0768356 -0.1625613 0.2917242 ] [ -0.126914 0.0556713 0.1255541 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.007614663693567e-11 2.235582728243693e-10 -8.103472890916032e-11 ] [ 1.6244068214136e-10 6.29955659873138e-10 3.528308547795898e-10 ] [ 1.33803857874167e-10 -1.521095268551175e-10 -6.204108528723841e-12 ] [ -2.884214320114848e-10 -2.15598819589897e-10 -5.737570718513089e-10 ] [ 1.260629415307719e-10 -9.342243810586176e-11 -3.091409402893325e-10 ] [ 2.726329427194733e-10 -2.21126328931657e-10 -5.124754182823296e-11 ] [ -1.231042019651405e-10 -2.60451914306855e-10 4.673936929615834e-10 ] [ -2.033386436522112e-10 8.919525530954304e-11 2.011598436655853e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 30.154483 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.831280767491105e-18 } }