{ "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" [ 5.4419 0 0 ] "si-unit" "m" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.361794 5.44502 0 ] "si-unit" "m" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0366443 0.298499 5.53333 ] "si-unit" "m" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.128377 -0.150066 -0.170326 ] [ 1.39649 1.37402 1.31098 ] [ -0.0542726 2.97617 3.14736 ] [ 1.41657 4.24499 4.02908 ] [ 2.7363 -0.234712 2.6251 ] [ 4.24505 1.08558 3.99518 ] [ 2.94651 2.56191 -0.00354123 ] [ 4.33312 3.8007 1.43779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.28377e-11 -1.50066e-11 -1.70326e-11 ] [ 1.39649e-10 1.37402e-10 1.31098e-10 ] [ -5.42726e-12 2.97617e-10 3.14736e-10 ] [ 1.41657e-10 4.24499e-10 4.02908e-10 ] [ 2.7363e-10 -2.34712e-11 2.6251e-10 ] [ 4.24505e-10 1.08558e-10 3.99518e-10 ] [ 2.94651e-10 2.56191e-10 -3.54123e-13 ] [ 4.33312e-10 3.8007e-10 1.43779e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.7200584999999995 -2.7631452999999997 7.232814599999999 ] [ -2.8570934999999995 1.2965890999999998 3.0546369999999996 ] [ 2.5719744999999996 -6.751714399999999 -4.686629299999999 ] [ 4.395732399999999 -0.33812479999999995 1.7661506999999999 ] [ -1.5849841999999998 2.5038183999999997 1.0328469999999998 ] [ -5.446462999999999 5.074673899999999 -3.3035666999999997 ] [ -0.6564106999999999 -0.4750519999999999 -1.3133455999999997 ] [ -0.14281389999999997 1.4529549999999998 -3.7829076999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.960190756708316e-09 -4.427046799533402e-09 1.15882464547009e-08 ] [ -4.577568409139645e-09 2.077364742804113e-09 4.894067986430649e-09 ] [ 4.120757413193769e-09 -1.08174389619987e-08 -7.508807894816267e-09 ] [ 7.042739682573073e-09 -5.417356494726758e-10 2.829685360349554e-09 ] [ -2.539424629577391e-09 4.011559303208862e-09 1.654803316263417e-09 ] [ -8.726195684652229e-09 8.130523880763955e-09 -5.292897331993407e-09 ] [ -1.051685877182962e-09 -7.611172080642815e-10 -2.104211615350548e-09 ] [ -2.288130917052691e-10 2.327890532074464e-09 -6.060886275584299e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.009273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.128450884940468e-18 } }