{ "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" [ 5.44714 0 0 ] "si-unit" "m" "si-value" [ 5.44714e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103058 5.37075 0 ] "si-unit" "m" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0454409 0.00880856 5.43207 ] "si-unit" "m" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.092279 -0.1565 0.140236 ] [ 1.30169 1.48453 1.67094 ] [ -0.064284 2.41697 2.49469 ] [ 1.35107 4.20911 4.05148 ] [ 2.6753 0.0424873 2.71018 ] [ 4.05146 1.3988 4.09778 ] [ 2.74223 2.69898 0.420733 ] [ 4.21922 4.15138 1.78205 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.227900000000001e-12 -1.565e-11 1.40236e-11 ] [ 1.30169e-10 1.48453e-10 1.67094e-10 ] [ -6.4284e-12 2.41697e-10 2.49469e-10 ] [ 1.35107e-10 4.20911e-10 4.05148e-10 ] [ 2.6753e-10 4.24873e-12 2.71018e-10 ] [ 4.05146e-10 1.3988e-10 4.09778e-10 ] [ 2.74223e-10 2.69898e-10 4.20733e-11 ] [ 4.21922e-10 4.15138e-10 1.78205e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.23274020000000006 3.8099939000000007 0.4316181000000001 ] [ 9.688657600000003 -9.826543300000003 -9.755117600000002 ] [ -7.026865100000002 11.693165800000001 12.967242000000004 ] [ 1.1901351000000002 -9.195907300000002 0.8804982000000002 ] [ -1.5758703000000005 2.5380597000000003 4.0180544000000005 ] [ -0.33808970000000005 -1.4471145000000003 1.9095197000000004 ] [ -1.8763663000000004 4.829146300000001 -5.824624000000001 ] [ 0.17113890000000004 -2.4008006000000006 -4.627190800000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.728909071603163e-10 6.104283151970614e-09 6.915284289341166e-10 ] [ 1.552294069365624e-08 -1.574385793853889e-08 -1.562942135187461e-08 ] [ -1.125827898073546e-08 1.873451686789813e-08 2.077581196865584e-08 ] [ 1.90680663281347e-09 -1.473346768310405e-08 1.410713630696483e-09 ] [ -2.524822552073083e-09 4.066419913534662e-09 6.437632820782573e-09 ] [ -5.416794130732859e-10 -2.318533019520682e-09 3.05938782029703e-09 ] [ -3.006270217917e-09 7.737145300282825e-09 -9.33207639775058e-09 ] [ 2.741947444894292e-10 -3.846506592522614e-09 -7.413576919740851e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.4703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.721662566796225e-18 } }