{ "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" [ [ 5.2031339 0.7890446 -2.8349557 ] [ -0.1774385 0.2434838 6.6282127 ] [ 7.0374947 5.0799633 -6.2809652 ] [ -8.6451803 3.6619584 -4.1919373 ] [ 0.4868405 1.2274767 -2.5782376 ] [ -4.8777474 -3.9386209 -1.1659601 ] [ 3.9302229 -3.0388604 3.432285 ] [ -2.9573259 -4.0244455 6.9915582 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.336339558153292e-09 1.264188821303876e-09 -4.542099780965114e-09 ] [ -2.84287818672009e-10 3.901040551175292e-10 1.061956751312205e-08 ] [ 1.127530957023884e-08 8.138998500837532e-09 -1.006321568240714e-08 ] [ -1.385110587337711e-08 5.867104183160025e-09 -6.716223993253047e-09 ] [ 7.80004473584877e-10 1.966634487519427e-09 -4.130792039620238e-09 ] [ -7.815012910834251e-09 -6.31036637616405e-09 -1.868074028396303e-09 ] [ 6.296911296791718e-09 -4.868791126867893e-09 5.499126828228689e-09 ] [ -4.73815845610302e-09 -6.447872544906446e-09 1.12017111832911e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -23.689892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.795539142438353e-18 } }