{ "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" [ [ 0.8928969999999999 -0.046607499999999996 4.310622899999999 ] [ -0.49267949999999994 -1.2158271999999999 0.22242469999999998 ] [ 0.4508596999999999 -3.9654192999999998 -2.1989111999999995 ] [ 4.110855299999999 -1.1026933999999997 1.1498409999999997 ] [ -1.8659461999999998 2.6270953999999995 1.0012422999999997 ] [ -2.4567332999999993 2.8601331999999995 -0.14195679999999997 ] [ -0.6844934999999999 -0.49142849999999993 -1.0091242999999999 ] [ 0.045240499999999996 1.3347472999999999 -3.3341384999999994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.430578709968698e-09 -7.467344746915498e-11 6.906379288365317e-09 ] [ -7.893595829508028e-10 -1.947969930821644e-09 3.563636571644597e-10 ] [ 7.223568765522496e-10 -6.353302146472635e-09 -3.5230441448809e-09 ] [ 6.586316307415057e-09 -1.766709599946015e-09 1.842248383015193e-09 ] [ -2.98957540194109e-09 4.209070865168882e-09 1.604167018032418e-09 ] [ -3.936120689229711e-09 4.582438583167648e-09 -2.274398679974111e-10 ] [ -1.096679491824879e-09 -7.873552599816689e-10 -1.616795374261606e-09 ] [ 7.248327201047699e-11 2.138500936354588e-09 -5.341878799219808e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.874005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.266996267699916e-18 } }