{ "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" [ 5.5048 0 0 ] "si-unit" "m" "si-value" [ 5.5048e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0192448 5.36034 0 ] "si-unit" "m" "si-value" [ 1.92448e-12 5.36034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.190348 0.0157222 5.58687 ] "si-unit" "m" "si-value" [ 1.90348e-11 1.57222e-12 5.58687e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0113409 -0.0687251 -0.0764128 ] [ 1.39555 1.34846 1.39039 ] [ 0.152538 2.8802 2.74744 ] [ 1.52254 4.15487 3.86439 ] [ 2.76536 0.0171046 2.52424 ] [ 4.13989 1.28016 4.0502 ] [ 2.78466 2.66896 -0.17742 ] [ 4.2307 4.05829 1.13615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.13409e-12 -6.87251e-12 -7.641280000000001e-12 ] [ 1.39555e-10 1.34846e-10 1.39039e-10 ] [ 1.52538e-11 2.8802e-10 2.74744e-10 ] [ 1.52254e-10 4.15487e-10 3.864390000000001e-10 ] [ 2.76536e-10 1.71046e-12 2.52424e-10 ] [ 4.13989e-10 1.28016e-10 4.0502e-10 ] [ 2.78466e-10 2.66896e-10 -1.7742e-11 ] [ 4.2307e-10 4.058290000000001e-10 1.13615e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6419847 1.5638963 -1.5481023 ] [ -0.193775 0.5052957 -1.2005662 ] [ -1.325188 -1.6233639 -1.5942082 ] [ 0.4168558 -0.4621163 2.2726717 ] [ 1.0797696 0.1094431 0.3829706 ] [ 1.2685787 0.0905858 -0.3129605 ] [ -0.8495323 0.6980771 0.234307 ] [ -1.0386935 -0.881818 1.765888 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.028572877251302e-09 2.505638089215623e-09 -2.480333311666708e-09 ] [ -3.1046177469552e-10 8.095729571307707e-10 -1.923519097362697e-09 ] [ -2.12318523176471e-09 -2.600915687630709e-09 -2.55420310672765e-09 ] [ 6.678766170048807e-10 -7.403919319505991e-10 3.641221464493792e-09 ] [ 1.729981608970568e-09 1.753471761278765e-10 6.135865417737485e-10 ] [ 2.032487134784857e-09 1.451344509364646e-10 -5.014179963338783e-10 ] [ -1.361100789674452e-09 1.118442809135864e-09 3.754011974897856e-10 ] [ -1.664170441876925e-09 -1.412828183400614e-09 2.82926446855127e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.388578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.830092893575723e-18 } }