{ "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" [ [ -1.9492954 -0.447929 -1.1239205 ] [ 1.0761534 -0.1688312 -0.2701732 ] [ -3.0222699 -0.0425667 0.3712413 ] [ 1.6924409 2.0012482 -0.2295228 ] [ 0.1693455 -1.6724119 0.7408076 ] [ 2.4720945 -2.1016867 -2.4550129 ] [ -1.7717238 0.3657352 0.3662012 ] [ 1.3332548 2.0664419 2.6003792 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.123115516912984e-09 -7.176613715783233e-10 -1.800719148737847e-09 ] [ 1.724187817874431e-09 -2.704974015016089e-10 -4.328651846067226e-10 ] [ -4.842210175527553e-09 -6.819937156460735e-11 5.947941315353991e-10 ] [ 2.711589242065711e-09 3.206353078458083e-09 -3.677360641005543e-10 ] [ 2.713214009376864e-10 -2.679499246527708e-09 1.186904617230958e-09 ] [ 3.960732012308265e-09 -3.367273294986304e-09 -3.933364272142408e-09 ] [ -2.838614450874935e-09 5.859723868436122e-10 5.86719001148905e-10 ] [ 2.13610967012938e-09 3.310804900421532e-09 4.166266759454607e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -40.748492 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.528628121525583e-18 } }