{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46856e-10 0.0 0.0 ] "source-value" [ 5.46856 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] "source-value" [ 0.109414 5.47364 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] "source-value" [ 0.0853482 0.188746 5.50226 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.481298002378813e-09 -1.599627077143321e-09 -1.2268621010654e-09 ] [ 2.230861113742196e-10 1.136654590566835e-10 1.755295358708559e-09 ] [ 1.071209681048707e-09 -1.337862819966369e-09 -7.70668744206843e-10 ] [ -5.472629985967738e-10 5.189897082048404e-10 -1.510182843586906e-10 ] [ -5.422861573595828e-10 -4.561388828534496e-10 -1.715968812027389e-09 ] [ 4.539176251863725e-10 1.407106009599427e-09 1.450504167727037e-09 ] [ -3.064896584172326e-10 -1.281979540303513e-09 -1.514105933260597e-09 ] [ 1.129123559360765e-09 2.635846983188039e-09 2.172824348483322e-09 ] ] "source-value" [ [ -0.9245535 -0.9984087 -0.7657471 ] [ 0.1392394 0.0709444 1.0955692 ] [ 0.6685965 -0.8350283 -0.4810136 ] [ -0.3415747 0.3239279 -0.0942582 ] [ -0.3384684 -0.2846995 -1.0710235 ] [ 0.2833131 0.8782465 0.9053335 ] [ -0.1912958 -0.8001487 -0.9450306 ] [ 0.7047435 1.6451663 1.3561703 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.922614587985371e-18 "source-value" -36.966053 } }