{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4678601 -0.2174553 -0.9553882 ] [ -2.6306772 -1.4763801 2.0156949 ] [ -0.566468 -0.253473 -0.718362 ] [ 0.6968371 -1.1806346 -4.7643216 ] [ 2.3007358 -6.1044791 4.2983995 ] [ -2.7451509 6.9610971 -2.0151417 ] [ 3.4125833 2.2713249 2.1391192 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.4959451402515e-10 -3.484017977290502e-10 -1.530700637828195e-09 ] [ -4.214809506711606e-09 -2.365421679634366e-09 3.229499243445794e-09 ] [ -9.075817860313343e-10 -4.061085146040384e-10 -1.150942801671129e-09 ] [ 1.116456110126072e-09 -1.89158515382756e-09 -7.633284681492449e-09 ] [ 3.686185109397585e-09 -9.780453696182225e-09 6.886795185758411e-09 ] [ -4.398216592548079e-09 1.115290702873868e-08 -3.228612919339168e-09 ] [ 5.467561179792512e-09 3.639063653020898e-09 3.4272467713444e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.573053 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.69398983270793e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2728828 1.3588585 1.733668 ] [ 2.2882463 2.0736531 4.1148721 ] [ 1.5013594 3.5532503 2.2783109 ] [ 4.3696922 2.2159767 1.4499386 ] [ 4.7086717 1.7380528 3.6563926 ] [ 3.6275211 4.3268867 1.9738713 ] [ 3.9371345 3.9324389 4.2010475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2728828e-10 1.3588585e-10 1.733668e-10 ] [ 2.2882463e-10 2.0736531e-10 4.114872100000001e-10 ] [ 1.5013594e-10 3.5532503e-10 2.2783109e-10 ] [ 4.3696922e-10 2.2159767e-10 1.4499386e-10 ] [ 4.708671700000001e-10 1.7380528e-10 3.656392600000001e-10 ] [ 3.6275211e-10 4.326886700000001e-10 1.9738713e-10 ] [ 3.9371345e-10 3.9324389e-10 4.2010475e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 1.68e-05 2.4e-06 ] [ -9.4e-06 1.44e-05 -8.6e-06 ] [ 7.7e-06 -2.23e-05 1.38e-05 ] [ 3.1e-06 8.4e-06 -4.3e-06 ] [ 3.6e-06 1.02e-05 1.38e-05 ] [ 8e-07 -3.8e-06 -4.7e-06 ] [ -6e-07 -2.37e-05 -1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.491536090240001e-15 2.691656722944e-14 3.84522388992e-15 ] [ -1.506046023552e-14 2.307134333952e-14 -1.377871893888e-14 ] [ 1.233675998016e-14 -3.572853864384e-14 2.211003736704e-14 ] [ 4.96674752448e-15 1.345828361472e-14 -6.889359469440001e-15 ] [ 5.76783583488e-15 1.634220153216e-14 2.211003736704e-14 ] [ 1.28174129664e-15 -6.08827115904e-15 -7.53023011776e-15 ] [ -9.6130597248e-16 -3.797158591296e-14 -1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }