{ "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" [ [ 0.3126518 0.5217928 0.1846885 ] [ 0.8333114 2.588069 2.680495 ] [ 2.642381 0.0430457 2.992394 ] [ 2.45603 2.243401 1.184533 ] [ 2.245972 1.834771 2.762862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.126518e-11 5.217928e-11 1.846885e-11 ] [ 8.333114000000001e-11 2.588069e-10 2.680495e-10 ] [ 2.642381e-10 4.30457e-12 2.992394e-10 ] [ 2.45603e-10 2.243401e-10 1.184533e-10 ] [ 2.245972e-10 1.834771e-10 2.762862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0600837 0.884882 0.0026805 ] [ -45.127842 23.181757 6.4473021 ] [ 7.4887551 -31.0157615 9.2631048 ] [ 11.2098063 12.0439749 -45.4580838 ] [ 25.369197 -5.0948524 29.7449963 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.698441320231161e-09 1.417737252566746e-09 4.2946344320544e-12 ] [ -7.230277339955631e-08 3.714126909446675e-08 1.032971669185474e-08 ] [ 1.199830834011677e-08 -4.969272795160874e-08 1.484112994658026e-08 ] [ 1.796008957755655e-08 1.929657500628202e-08 -7.283187909072722e-08 ] [ 4.064593432186949e-08 -8.16285340170677e-09 4.76567376576425e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 23.485077 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.762724130708781e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2082237 1.8493653 0.2189431 ] [ 0.0639722 2.0150678 2.6469211 ] [ 3.0892774 -0.1970537 3.7635835 ] [ 2.6365789 1.6994463 0.3737329 ] [ 2.4922939 1.8642537 2.8017919 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.082237e-11 1.8493653e-10 2.189431e-11 ] [ 6.397220000000001e-12 2.0150678e-10 2.6469211e-10 ] [ 3.0892774e-10 -1.970537e-11 3.7635835e-10 ] [ 2.6365789e-10 1.6994463e-10 3.737329e-11 ] [ 2.4922939e-10 1.8642537e-10 2.8017919e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 9.4e-06 -3.4e-06 ] [ 1.48e-05 1.4e-06 -9.9e-06 ] [ 9.8e-06 1.17e-05 3.17e-05 ] [ -1.93e-05 2.03e-05 -2.56e-05 ] [ -8e-06 -4.28e-05 7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 1.506046023552e-14 -5.44740051072e-15 ] [ 2.371221398784e-14 2.24304726912e-15 -1.586154854592e-14 ] [ 1.570133088384e-14 1.874546646336e-14 5.078899887936e-14 ] [ -3.092200878144e-14 3.252418540224e-14 -4.101572149248001e-14 ] [ -1.28174129664e-14 -6.857315937023999e-14 1.169588933184e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.7587726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.563527730742363e-18 } }