{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.992977 1.520628 1.322916 ] [ 2.351443 2.977576 3.35114 ] [ 0.8368319 3.514349 1.69894 ] [ 2.887807 3.844369 0.5466762 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992977e-10 1.520628e-10 1.322916e-10 ] [ 2.351443e-10 2.977576e-10 3.35114e-10 ] [ 8.368319e-11 3.514349e-10 1.69894e-10 ] [ 2.887807e-10 3.844369e-10 5.466762e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0892404 -8.6551653 -3.1188034 ] [ 2.4387808 1.1647954 8.0310833 ] [ -5.0954945 3.5812618 -1.1777968 ] [ 2.7459541 3.9091081 -3.7344831 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.429788825108403e-10 -1.386710349281942e-08 -4.996873892351551e-09 ] [ 3.907357581015921e-09 1.866207957895384e-09 1.286721390295731e-08 ] [ -8.163882159314986e-09 5.737813928924125e-09 -1.887038497013054e-09 ] [ 4.399503460809906e-09 6.263081605999909e-09 -5.983301513592708e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.3656412 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.180105812784126e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7175053 0.8900357 1.0706451 ] [ 2.2026081 3.3763927 3.8799291 ] [ 1.3320963 3.1643874 1.6710826 ] [ 2.8168493 4.4261062 0.2980154 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7175053e-10 8.900357e-11 1.0706451e-10 ] [ 2.2026081e-10 3.3763927e-10 3.8799291e-10 ] [ 1.3320963e-10 3.1643874e-10 1.6710826e-10 ] [ 2.8168493e-10 4.426106200000001e-10 2.980154e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.9e-06 6.5e-06 1.17e-05 ] [ 6.7e-06 -1.26e-05 -5.2e-06 ] [ -1.82e-05 1.33e-05 -1.1e-05 ] [ 1.6e-06 -7.2e-06 4.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.586154854592e-14 1.04141480352e-14 1.874546646336e-14 ] [ 1.073458335936e-14 -2.018742542208e-14 -8.33131842816e-15 ] [ -2.915961449856e-14 2.130894905664e-14 -1.76239428288e-14 ] [ 2.56348259328e-15 -1.153567166976e-14 7.2097947936e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.001145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.762577732103082e-18 } }