{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2134304 5.4452644 5.0302725 ] [ -3.8333369 -3.4590437 3.0666473 ] [ 1.0218629 0.6667122 -3.0474105 ] [ 4.8449125 -4.6230839 -3.6611322 ] [ -3.7350736 -1.97298 -3.2144874 ] [ 3.9006337 2.5666927 6.2677256 ] [ 0.8132985 2.5633675 -3.9314786 ] [ 2.2011332 -1.1869292 -0.5101367 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.352836301047993e-09 8.724275315754539e-09 8.059384995753169e-09 ] [ -6.141682760829948e-09 -5.541998946465529e-09 4.913310608299444e-09 ] [ 1.637204848042888e-09 1.068190699642134e-09 -4.882489857080438e-09 ] [ 7.76240553732168e-09 -7.406996940576885e-09 -5.86578041649807e-09 ] [ -5.984247598887292e-09 -3.161062429305984e-09 -5.150176560136178e-09 ] [ 6.249504120444601e-09 4.112295036718028e-09 1.004200342190965e-08 ] [ 1.303047842431709e-09 4.106967479018544e-09 -6.298923098095515e-09 ] [ 3.526604152306691e-09 -1.901670214784847e-09 -8.173290941520634e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.275256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.408671776473493e-18 } }