{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6948705 -2.7455615 2.3867518 ] [ -0.7527945 3.5541787 -0.0002968 ] [ 0.4318423 -0.7755657 -0.5364914 ] [ 1.1108231 -0.6996955 -4.4021341 ] [ 0.9049995 0.666644 2.5521705 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.715481890383606e-09 -4.398874446268579e-09 3.823997933612317e-09 ] [ -1.206109748166826e-09 5.694422019285336e-09 -4.7552602105344e-13 ] [ 6.918876369324999e-10 -1.242593232434387e-09 -8.595539783402611e-10 ] [ 1.77973480066458e-09 -1.121035771778967e-09 -7.052996336646449e-09 ] [ 1.44996904073569e-09 1.068081431196595e-09 4.089027907395446e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.739855775408902 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.594086109323999e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7563244 0.8223148 1.9725747 ] [ 2.35499 3.1351638 1.7043216 ] [ 2.864164 1.936654 3.7251881 ] [ 3.5025652 1.3976593 0.5027619 ] [ 4.6105264 2.511785 2.2554358 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7563244e-10 8.223148e-11 1.9725747e-10 ] [ 2.35499e-10 3.1351638e-10 1.7043216e-10 ] [ 2.864164e-10 1.936654e-10 3.7251881e-10 ] [ 3.5025652e-10 1.3976593e-10 5.027619e-11 ] [ 4.610526400000001e-10 2.511785e-10 2.2554358e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.02e-05 -5.21e-05 -1.66e-05 ] [ 0.0001059 1.21e-05 1.05e-05 ] [ 4.27e-05 -8.7e-06 -4.29e-05 ] [ -3.2e-06 6.2e-06 6.73e-05 ] [ -9.52e-05 4.25e-05 -1.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.042926636416e-14 -8.347340194367999e-14 -2.659613190528e-14 ] [ 1.6967050414272e-13 1.938633711168e-14 1.68228545184e-14 ] [ 6.841294170816001e-14 -1.393893660096e-14 -6.873337703232e-14 ] [ -5.126965186560001e-15 9.93349504896e-15 1.0782648657984e-13 ] [ -1.5252721430016e-13 6.8092506384e-14 -2.915961449856e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }