{ "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" [ [ -0.713345 -0.0606757 -1.1456308 ] [ 0.0829669 -0.6788571 0.1391269 ] [ -3.4068218 0.6124372 0.2069708 ] [ 0.3711213 2.2792199 -0.9040085 ] [ 2.0302739 -2.4660211 1.642904 ] [ 2.5625428 -2.3003653 -2.3511437 ] [ -1.2088599 0.5984445 0.3935617 ] [ 0.2821218 2.0158176 2.0182196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.142904681564576e-09 -9.721318799067456e-11 -1.835502883828401e-09 ] [ 1.329276274802515e-10 -1.087648974484088e-09 2.229058665043795e-10 ] [ -5.458330239191773e-09 9.812325635482137e-10 3.316037769482727e-10 ] [ 5.94601870340903e-10 3.651712837442114e-09 -1.448381283704477e-09 ] [ 3.252857376400437e-09 -3.951001352819499e-09 2.632222379018803e-09 ] [ 4.10564616395937e-09 -3.685591502959579e-09 -3.766947468281209e-09 ] [ -1.936807069602626e-09 9.588137867463457e-10 6.305553545823034e-10 ] [ 4.520089521780134e-10 3.229695830517167e-09 3.233544258760328e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -216.05476 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.46157885284555e-17 } }