{ "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" [ 5.39143 0 0 ] "si-unit" "m" "si-value" [ 5.39143e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.144963 5.17841 0 ] "si-unit" "m" "si-value" [ 1.44963e-11 5.178410000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.144779 0.421312 5.38784 ] "si-unit" "m" "si-value" [ -1.44779e-11 4.21312e-11 5.38784e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.15223 0.0692904 -0.00428898 ] [ 1.42734 1.24068 1.17973 ] [ -0.332931 2.76994 2.80275 ] [ 1.2591 4.25807 3.96691 ] [ 2.6931 0.104845 2.7319 ] [ 4.09744 1.52781 4.38962 ] [ 2.50984 2.47613 -0.202936 ] [ 4.16866 4.11218 1.07304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5223e-11 6.929040000000001e-12 -4.288980000000001e-13 ] [ 1.42734e-10 1.24068e-10 1.17973e-10 ] [ -3.32931e-11 2.76994e-10 2.80275e-10 ] [ 1.2591e-10 4.25807e-10 3.96691e-10 ] [ 2.6931e-10 1.04845e-11 2.7319e-10 ] [ 4.09744e-10 1.52781e-10 4.38962e-10 ] [ 2.50984e-10 2.47613e-10 -2.02936e-11 ] [ 4.16866e-10 4.11218e-10 1.07304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 17.4827696 -20.5773745 8.6577349 ] [ -3.5167459 4.2933231 11.2208799 ] [ 9.1433053 0.8138561 -2.8675325 ] [ -8.6540828 2.3494462 -3.4321326 ] [ 5.1273104 3.6540991 0.51034 ] [ -26.8464416 15.0285298 -21.0498168 ] [ 14.4203078 -0.096641 4.2642345 ] [ -7.1564228 -5.4652387 2.6962927 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.801048495072553e-08 -3.296858861296743e-08 1.387122056014632e-08 ] [ -5.6344481086953e-09 6.878661953032445e-09 1.797783158870025e-08 ] [ 1.464919010918836e-08 1.303941226858367e-09 -4.594293568735604e-09 ] [ -1.386536925086129e-08 3.76422780448009e-09 -5.498882656509668e-09 ] [ 8.214856918145193e-09 5.854512196340428e-09 8.1765482339556e-10 ] [ -4.301274143756557e-08 2.407835928893269e-08 -3.372552462694064e-08 ] [ 2.310388021224794e-08 -1.54835952086394e-10 6.832056877796672e-09 ] [ -1.146585339318485e-08 -8.756277744372534e-09 4.319937162364771e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.119843 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.024642550434846e-18 } }