{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2422976 0.2155702 0.7539187 ] [ 0.1069263 2.303076 0.5134626 ] [ 0.4438839 2.233015 2.726304 ] [ 2.36111 0.1695128 0.2725886 ] [ 2.483594 1.001172 2.982027 ] [ 2.63043 2.516837 1.068712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.422976e-11 2.155702e-11 7.539187e-11 ] [ 1.069263e-11 2.303076e-10 5.134626e-11 ] [ 4.438839e-11 2.233015e-10 2.726304e-10 ] [ 2.36111e-10 1.695128e-11 2.725886e-11 ] [ 2.483594e-10 1.001172e-10 2.982027e-10 ] [ 2.63043e-10 2.516837e-10 1.068712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.346758 -2.9701711 -0.1830118 ] [ -0.5402566 3.0722431 2.8103153 ] [ 8.0699022 -4.460629 -1.5052514 ] [ 1.2447397 -0.1614634 0.0053643 ] [ -7.9718137 9.216792 -6.1777123 ] [ -0.4558136 -4.6967718 5.0502958 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.555675606753665e-10 -4.75873869619582e-09 -2.932172272905255e-10 ] [ -8.655864937528973e-10 4.922276068234117e-09 4.502621470736539e-09 ] [ 1.292940863698248e-08 -7.146715497862483e-09 -2.411678601506469e-09 ] [ 1.994292846321606e-09 -2.586928845948787e-10 8.59455604695744e-12 ] [ -1.277225353551314e-08 1.476692866117647e-08 -9.897786217088595e-09 ] [ -7.302938933626829e-10 -7.525057971192732e-09 8.091465858884433e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9192779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.108590528419812e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.19288 0.3271301 -0.1581174 ] [ -0.7356753 1.8780632 1.1093578 ] [ 0.348213 2.4778724 2.9390806 ] [ 2.400717 0.2572164 -0.1080933 ] [ 2.49408 2.0656722 3.1797668 ] [ 3.568027 1.4332286 1.3550185 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9288e-11 3.271301e-11 -1.581174e-11 ] [ -7.356753000000001e-11 1.8780632e-10 1.1093578e-10 ] [ 3.48213e-11 2.4778724e-10 2.9390806e-10 ] [ 2.400717000000001e-10 2.572164e-11 -1.080933e-11 ] [ 2.49408e-10 2.0656722e-10 3.1797668e-10 ] [ 3.568027e-10 1.4332286e-10 1.3550185e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.4881585 0.3604707 -0.0270019 ] [ 0.2339735 -0.2614784 0.5275101 ] [ -0.9987959 0.0642044 -0.4783153 ] [ -0.1154571 0.3557903 0.2785394 ] [ 0.9311572 0.0383767 -0.4226818 ] [ -0.5390363 -0.5573637 0.1219495 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.821161359447968e-10 5.775377280234105e-10 -4.326181289717952e-11 ] [ 3.748668715867489e-10 -4.189345793241907e-10 8.451643494558701e-10 ] [ -1.600247439930895e-09 1.028667886324915e-10 -7.663455910309383e-10 ] [ -1.849826663253677e-10 5.700389005674183e-10 4.462693146516595e-10 ] [ 1.49187829612959e-09 6.148625152345536e-11 -6.772108979976615e-10 ] [ -8.636313576225351e-10 -8.92995089422585e-10 1.953846378182496e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.723835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.359018420551677e-18 } }