{ "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" [ 5.05932 0 0 ] "si-unit" "m" "si-value" [ 5.059319999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.224512 5.44129 0 ] "si-unit" "m" "si-value" [ 2.24512e-11 5.441290000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.327401 0.688972 5.24092 ] "si-unit" "m" "si-value" [ 3.27401e-11 6.88972e-11 5.24092e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.119472 0.0796179 0.152764 ] [ 1.48092 1.5486 0.772169 ] [ 0.0612704 2.84226 2.7863 ] [ 1.84412 4.4971 3.9905 ] [ 2.88701 0.305191 2.51679 ] [ 4.25223 1.88781 3.92663 ] [ 2.58737 2.78734 -0.624797 ] [ 3.988 4.24006 0.48768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.19472e-11 7.96179e-12 1.52764e-11 ] [ 1.48092e-10 1.5486e-10 7.72169e-11 ] [ 6.127040000000001e-12 2.84226e-10 2.786300000000001e-10 ] [ 1.84412e-10 4.4971e-10 3.9905e-10 ] [ 2.88701e-10 3.05191e-11 2.51679e-10 ] [ 4.25223e-10 1.88781e-10 3.92663e-10 ] [ 2.58737e-10 2.78734e-10 -6.247970000000001e-11 ] [ 3.988e-10 4.24006e-10 4.8768e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 15.9784447 10.403973 -5.545855 ] [ -3.2174489 1.763288 8.9927993 ] [ 24.7064494 11.4173419 -28.3731174 ] [ -25.8047536 21.0179572 -16.7665232 ] [ -0.495506 0.4619832 -1.2711186 ] [ -13.7747308 -12.9450339 9.5750603 ] [ 14.9715286 -16.9172247 22.461056 ] [ -12.3639833 -15.2022848 10.9276987 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.560029053508567e-08 1.666900230403444e-08 -8.885439223346785e-09 ] [ -5.154921406198678e-09 2.82509880933719e-09 1.440805279400661e-08 ] [ 3.958409561165819e-08 1.829259826386025e-08 -4.545874535749369e-08 ] [ -4.134377292342464e-08 3.367447964281503e-08 -2.686293148314081e-08 ] [ -7.938881286661248e-10 7.401786822423706e-10 -2.036556503184027e-09 ] [ -2.206955164557368e-08 -2.074023067004345e-08 1.534093775541024e-08 ] [ 2.398703310055856e-08 -2.710438190316029e-08 3.598657880167957e-08 ] [ -1.980928498322163e-08 -2.43567452893032e-08 1.750810337628655e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.883647 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.903970139324006e-18 } }