{ "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" [ [ 2.420109 0.1444118 2.696301 ] [ 1.741529 2.490211 2.002098 ] [ 2.88298 4.123868 0.919121 ] [ 3.624829 1.629307 1.356835 ] [ 3.547112 2.169997 3.636924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.420109e-10 1.444118e-11 2.696301e-10 ] [ 1.741529e-10 2.490211e-10 2.002098e-10 ] [ 2.88298e-10 4.123868e-10 9.19121e-11 ] [ 3.624829e-10 1.629307e-10 1.356835e-10 ] [ 3.547112e-10 2.169997e-10 3.636924e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9833899 -19.9288734 4.1221188 ] [ -20.8298848 11.5399867 -2.6466757 ] [ 0.2469692 8.7659614 -4.2724671 ] [ 15.9187588 -6.459956 -15.405981 ] [ 9.6475466 6.0828813 18.203005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.98427079011085e-09 -3.192957504036301e-08 6.604362369520151e-09 ] [ -3.337315444051728e-08 1.848909689508294e-08 -4.240441929379475e-09 ] [ 3.956882782976794e-10 1.404461841391524e-08 -6.845246900757176e-09 ] [ 2.550466318151426e-08 -1.034999047459668e-08 -2.468310257868901e-08 ] [ 1.545707361059853e-08 9.74585020596151e-09 2.916442903930551e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.502154 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.362195236524121e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.575114 0.3280918 2.6577896 ] [ 1.7687811 3.6763902 2.754531 ] [ 2.7337621 3.4324383 0.6234685 ] [ 3.850137 1.3630762 0.5636794 ] [ 2.2887648 1.7577983 4.0118104 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.575114e-10 3.280918e-11 2.6577896e-10 ] [ 1.7687811e-10 3.6763902e-10 2.754531e-10 ] [ 2.7337621e-10 3.4324383e-10 6.234685e-11 ] [ 3.850137e-10 1.3630762e-10 5.636794000000001e-11 ] [ 2.2887648e-10 1.7577983e-10 4.0118104e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 3e-06 -1.4e-06 ] [ 1.4e-06 -3.9e-06 1.5e-06 ] [ -4e-07 -1.7e-06 3.4e-06 ] [ 4e-07 -1.1e-06 4e-07 ] [ -4e-07 3.7e-06 -3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 4.8065298624e-15 -2.24304726912e-15 ] [ 2.24304726912e-15 -6.24848882112e-15 2.4032649312e-15 ] [ -6.408706483200001e-16 -2.72370025536e-15 5.44740051072e-15 ] [ 6.408706483200001e-16 -1.76239428288e-15 6.408706483200001e-16 ] [ -6.408706483200001e-16 5.928053496960001e-15 -5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }