{ "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" [ 5.40836 0 0 ] "si-unit" "m" "si-value" [ 5.40836e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0676972 5.56169 0 ] "si-unit" "m" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0290382 0.0456166 5.46301 ] "si-unit" "m" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.160852 -0.0174641 0.0414383 ] [ 1.3693 1.3835 1.35672 ] [ 0.168786 2.76991 2.61562 ] [ 1.32577 4.00891 4.07743 ] [ 2.71647 0.0672876 2.67609 ] [ 4.01486 1.47906 4.19059 ] [ 2.74225 2.69331 -0.0428987 ] [ 4.04746 4.06755 1.1226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60852e-11 -1.74641e-12 4.14383e-12 ] [ 1.3693e-10 1.3835e-10 1.35672e-10 ] [ 1.68786e-11 2.76991e-10 2.61562e-10 ] [ 1.32577e-10 4.008910000000001e-10 4.07743e-10 ] [ 2.71647e-10 6.728760000000001e-12 2.67609e-10 ] [ 4.01486e-10 1.47906e-10 4.19059e-10 ] [ 2.74225e-10 2.69331e-10 -4.28987e-12 ] [ 4.04746e-10 4.06755e-10 1.1226e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2635463 -0.4446899 -1.3312352 ] [ 1.3808354 -0.2217141 -0.6256982 ] [ -3.3805685 -0.0655024 0.4652466 ] [ 2.0398004 2.2129968 0.051267 ] [ 0.3323101 -1.5325288 0.7550551 ] [ 2.7329248 -2.2835248 -2.6155341 ] [ -2.345286 0.7245076 0.6235896 ] [ 1.5035301 1.6104555 2.6773091 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.626600961958343e-09 -7.1247176128589e-10 -2.132873914226012e-09 ] [ 2.212342195053016e-09 -3.552251475217133e-10 -1.002479027716643e-09 ] [ -5.416267815712925e-09 -1.049464138862899e-10 7.454072254266893e-10 ] [ 3.268120511978488e-09 3.545611734865214e-09 8.21387888185536e-11 ] [ 5.3241947307571e-10 -2.455381814062679e-09 1.209731628635806e-09 ] [ 4.378628220964517e-09 -3.658610047576996e-09 -4.190547585925169e-09 ] [ -3.757562398289549e-09 1.160789138311918e-09 9.991006780940236e-10 ] [ 2.408920774889086e-09 2.580234150938774e-09 4.289522046675089e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.398647 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.671488463135205e-18 } }