{ "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" [ 5.5048 0 0 ] "si-unit" "m" "si-value" [ 5.5048e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0192448 5.36034 0 ] "si-unit" "m" "si-value" [ 1.92448e-12 5.36034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.190348 0.0157222 5.58687 ] "si-unit" "m" "si-value" [ 1.90348e-11 1.57222e-12 5.58687e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0113409 -0.0687251 -0.0764128 ] [ 1.39555 1.34846 1.39039 ] [ 0.152538 2.8802 2.74744 ] [ 1.52254 4.15487 3.86439 ] [ 2.76536 0.0171046 2.52424 ] [ 4.13989 1.28016 4.0502 ] [ 2.78466 2.66896 -0.17742 ] [ 4.2307 4.05829 1.13615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.13409e-12 -6.87251e-12 -7.641280000000001e-12 ] [ 1.39555e-10 1.34846e-10 1.39039e-10 ] [ 1.52538e-11 2.8802e-10 2.74744e-10 ] [ 1.52254e-10 4.15487e-10 3.864390000000001e-10 ] [ 2.76536e-10 1.71046e-12 2.52424e-10 ] [ 4.13989e-10 1.28016e-10 4.0502e-10 ] [ 2.78466e-10 2.66896e-10 -1.7742e-11 ] [ 4.2307e-10 4.058290000000001e-10 1.13615e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.748672 2.2915499 -1.6899084 ] [ -0.5676848 0.9154847 -1.8965999 ] [ -2.237671 -2.2763679 -1.2015446 ] [ 0.8095307 -0.9931696 3.1596808 ] [ 1.7539601 0.3232242 0.3030821 ] [ 2.0198131 0.3172149 -0.3859507 ] [ -1.5622986 0.8084598 0.0403801 ] [ -0.9643216 -1.386396 1.6708606 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.199504784930048e-09 3.671467705425036e-09 -2.707531752080325e-09 ] [ -9.095313220369631e-10 1.4667681951245e-09 -3.038688043826736e-09 ] [ -3.585144190779414e-09 -3.647143459767648e-09 -1.925086682828876e-09 ] [ 1.297011172045664e-09 -1.591233126719126e-09 5.062366748658427e-09 ] [ 2.810153889188303e-09 5.178622607833428e-10 4.855910588036514e-10 ] [ 3.236097353867105e-09 5.082343007366466e-10 -6.183611934159436e-10 ] [ -2.503078312250912e-09 1.295295401088313e-09 6.46960526985834e-11 ] [ -1.545013535181494e-09 -2.221251276671064e-09 2.67701381199122e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.152676292303475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.471861994409438e-18 } }