{ "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" [ [ 0.4019724 -2.2863239 -0.2467207 ] [ 0.3507471 1.192471 0.6933181 ] [ 1.2267961 -0.8697543 1.5091089 ] [ -2.3661163 2.4259227 -3.1497676 ] [ -0.394024 -0.7371191 1.0879524 ] [ -0.8685354 2.3652179 -1.3551974 ] [ 3.4041625 -2.813779 2.9415936 ] [ -1.7550023 0.7233646 -1.4802873 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.44030781486866e-10 -3.663094700156278e-09 -3.952901374074106e-10 ] [ 5.619588034333997e-10 1.910549157181997e-09 1.110818050597477e-09 ] [ 1.965544029908619e-09 -1.393500005300269e-09 2.417858997821205e-09 ] [ -3.790936217953799e-09 3.886756633808013e-09 -5.046484009673327e-09 ] [ -6.312960408340992e-10 -1.180994988765137e-09 1.74309189982325e-09 ] [ -1.391547112217176e-09 3.789496822477672e-09 -2.171265590848946e-09 ] [ 5.45406957090408e-09 -4.508170929898003e-09 4.712952493814907e-09 ] [ -2.811823654510228e-09 1.158957850434344e-09 -2.371681704127156e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.433198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.677024143577732e-18 } }