{ "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" [ 5.42631 0 0 ] "si-unit" "m" "si-value" [ 5.42631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0419811 5.40206 0 ] "si-unit" "m" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.291495 -0.184222 5.7849 ] "si-unit" "m" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5070116 -2.1800204 -2.133503 ] [ 0.6565452 0.36052 4.0027508 ] [ -2.859546 -5.7627008 -5.1672197 ] [ -0.4916968 0.7907129 9.2735969 ] [ 2.7083019 2.0777895 -5.5326445 ] [ 1.5453141 1.4359452 2.9972797 ] [ 1.4238009 1.6280916 -2.8743474 ] [ -0.4757077 1.6496619 -0.5659129 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.016675406686954e-09 -3.492777746523334e-09 -3.418248655168902e-09 ] [ 1.051901378604857e-09 5.7761672008968e-10 6.413113803484807e-09 ] [ -4.581497785048163e-09 -9.232864570493107e-09 -8.27879866608449e-09 ] [ -7.877851239725711e-10 1.266861732582379e-09 1.485794026631483e-08 ] [ 4.339178021997803e-09 3.328985787270543e-09 -8.864273742128612e-09 ] [ 2.475866143210739e-09 2.300637847144456e-09 4.802171500902529e-09 ] [ 2.28118053344817e-09 2.608490319531674e-09 -4.605212242278651e-09 ] [ -7.621677615538818e-10 2.643049750180044e-09 -9.066924252591786e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.196126074190158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.075558465938562e-18 } }