{ "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" [ 5.46856 0 0 ] "si-unit" "m" "si-value" [ 5.46856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] "si-unit" "m" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] "si-unit" "m" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3387493 -0.816826 -0.2843992 ] [ 0.0512486 -0.4371328 1.536723 ] [ 0.9270404 -0.3822705 0.0046964 ] [ -0.8240897 -0.0610436 -0.9534314 ] [ -0.947746 0.8896754 -0.2301912 ] [ 0.4225015 0.5497396 0.6281008 ] [ -0.1278005 -0.9040572 -0.9904415 ] [ 1.8375951 1.1619151 0.288943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.144912847243856e-09 -1.308699531243684e-09 -4.556577529682928e-10 ] [ 8.21093094452124e-11 -7.003639581149951e-10 2.462101683530382e-09 ] [ 1.485282467654014e-09 -6.124648629674969e-10 7.5244623439176e-12 ] [ -1.32033726166007e-09 -9.78026295752424e-11 -1.527565511201907e-09 ] [ -1.518456496166964e-09 1.425417137724603e-09 -3.688069619924208e-10 ] [ 6.769220311299509e-10 8.807799419045063e-10 1.006328425556707e-09 ] [ -2.04758974913517e-10 -1.448459321639465e-09 -1.586862228643911e-09 ] [ 2.944151931972893e-09 1.861593223911773e-09 4.62937723157862e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.573733 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.539322716275472e-18 } }