{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6694659 -2.8868859 -0.6310928 ] [ 0.4387396 1.2188988 1.3310792 ] [ 1.5002425 -1.0485364 1.5280259 ] [ -3.9782433 2.3971013 -2.5836733 ] [ 0.4268985 0.046883 -0.1736657 ] [ -1.07693 2.7456052 -1.4157186 ] [ 3.0473601 -4.1188816 2.2244748 ] [ -1.0275332 1.6458156 -0.2794295 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.07260262223978e-09 -4.625301134004059e-09 -1.011122138045635e-09 ] [ 7.029383355305064e-10 1.952891176570639e-09 2.132623992243412e-09 ] [ 2.403653478833745e-09 -1.679940519978477e-09 2.44816739312682e-09 ] [ -6.373848459627052e-09 3.840579692191024e-09 -4.139500991149672e-09 ] [ 6.83966801789649e-10 7.511484713182198e-11 -2.782431266672538e-10 ] [ -1.72543208245362e-09 4.398944497628897e-09 -2.268231261239192e-09 ] [ 4.882409147603903e-09 -6.599175857732533e-09 3.564001547481823e-09 ] [ -1.646289683699249e-09 2.63688729819269e-09 -4.476954157503029e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -31.685561 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.076586546938167e-18 } }