{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7501542999999998 1.9042051999999996 -1.0013557999999998 ] [ 0.3277458999999999 -0.8051540999999998 -0.6543223999999999 ] [ -0.8441073999999997 1.8807990999999995 -0.10544649999999997 ] [ -0.002458300000000001 -1.1242881999999998 0.4091884999999999 ] [ -0.5352625999999999 0.26177419999999996 -0.11695489999999997 ] [ 1.0448607999999997 -1.0580468999999997 0.44961839999999986 ] [ -1.8218250999999996 0.15490049999999997 -0.8711590999999997 ] [ 1.0808923999999998 -1.2141897999999998 1.8904317999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.201879681452589e-09 3.050873052645788e-09 -1.60434885186248e-09 ] [ 5.251068185430546e-10 -1.289999075161265e-09 -1.048340051745746e-09 ] [ -1.352409141724273e-09 3.013372346441681e-09 -1.689439170451871e-10 ] [ -3.938630786912642e-12 -1.801308269081314e-09 6.555922482002206e-10 ] [ -8.57585223708622e-10 4.194085031686233e-10 -1.873824064680019e-10 ] [ 1.674051545750384e-09 -1.695178006889915e-09 7.203680887615025e-10 ] [ -2.918885582406621e-09 2.481779596502304e-10 -1.395750743017169e-09 ] [ 1.731780532880402e-09 -1.945346510773828e-09 3.028805633176861e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -41.511747 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.650915053196454e-18 } }