{ "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" [ 5.43593 0 0 ] "si-unit" "m" "si-value" [ 5.43593e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00214695 5.43123 0 ] "si-unit" "m" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0452237 0.0446124 5.47348 ] "si-unit" "m" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0488145 -0.0723712 0.108622 ] [ 1.36095 1.35641 1.2952 ] [ -0.00863748 2.68477 2.74572 ] [ 1.30162 4.04466 3.93872 ] [ 2.7765 -0.0432881 2.8136 ] [ 4.0674 1.36091 4.19847 ] [ 2.70508 2.80909 0.166723 ] [ 4.1715 4.08924 1.48814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.88145e-12 -7.23712e-12 1.08622e-11 ] [ 1.36095e-10 1.35641e-10 1.2952e-10 ] [ -8.63748e-13 2.68477e-10 2.74572e-10 ] [ 1.30162e-10 4.044660000000001e-10 3.93872e-10 ] [ 2.7765e-10 -4.328810000000001e-12 2.8136e-10 ] [ 4.0674e-10 1.36091e-10 4.19847e-10 ] [ 2.70508e-10 2.80909e-10 1.66723e-11 ] [ 4.1715e-10 4.089240000000001e-10 1.48814e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9318511 0.3166853 -1.3281266 ] [ -0.2666101 -0.3315713 1.8124493 ] [ 0.0159183 -0.4405904 -0.6445758 ] [ 0.2630395 0.4417494 2.4557594 ] [ -0.1625489 0.5114267 -1.0987173 ] [ -0.2661334 0.2863445 0.2259792 ] [ 0.5676792 -0.4463935 -1.6786323 ] [ -1.0831958 -0.3376508 0.2558641 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.492990046486763e-09 5.073857838110342e-10 -2.127893387982594e-09 ] [ -4.271564690891501e-10 -5.312357849882631e-10 2.903863894845326e-09 ] [ 2.550392810288064e-11 -7.059036382289204e-10 -1.032724277093457e-09 ] [ 4.214357372469216e-10 7.077605609324276e-10 3.934560296989835e-09 ] [ -2.604320473167571e-10 8.193959019928955e-10 -1.7603391709285e-09 ] [ -4.263927114940147e-10 4.587744633946657e-10 3.620585910270873e-10 ] [ 9.095223423544475e-10 -7.152012293770848e-10 -2.689465425979732e-09 ] [ -1.735470986508753e-09 -5.409762177544166e-10 4.099394791220332e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.868445 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.906976062425066e-18 } }