{ "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" [ 5.46856 0 0 ] "si-unit" "m" "si-value" [ 5.46856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] "si-unit" "m" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] "si-unit" "m" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3977514 -1.3250758 -0.9343769 ] [ -0.0349706 -0.1597922 2.062376 ] [ 1.0034632 -1.063732 -0.5183002 ] [ -0.8598035 0.5078975 -0.6863745 ] [ -0.5405518 -0.2827516 -1.5863767 ] [ 0.6100603 0.9485545 0.9196378 ] [ -0.2139275 -1.3286472 -1.4046589 ] [ 1.4334813 2.7035468 2.1480733 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.239444614770469e-09 -2.123005467547857e-09 -1.49703682419558e-09 ] [ -5.602907773534848e-11 -2.560153270261977e-10 3.304290610499021e-09 ] [ 1.607725278873155e-09 -1.704286541196825e-09 -8.304084629959641e-10 ] [ -1.377557066182013e-09 8.13741500262768e-10 -1.09969317701329e-09 ] [ -8.660594562913575e-10 -4.530180030137933e-10 -2.541655660521855e-09 ] [ 9.774243499382343e-10 1.519751843454634e-09 1.473422182763946e-09 ] [ -3.42749639046192e-10 -2.128727481131382e-09 -2.250511649778645e-09 ] [ 2.296690225213991e-09 4.331559476198653e-09 3.441592821024705e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -37.098778 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.943879477184939e-18 } }