{ "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" [ [ 1.839564 1.867321 2.162261 ] [ 1.684665 2.737292 4.133334 ] [ 1.168876 4.298629 2.101191 ] [ 4.284365 2.457862 3.031672 ] [ 3.236614 0.5901118 4.309357 ] [ 3.135041 3.239997 1.121025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.839564e-10 1.867321e-10 2.162261e-10 ] [ 1.684665e-10 2.737292e-10 4.133334e-10 ] [ 1.168876e-10 4.298629e-10 2.101191e-10 ] [ 4.284365e-10 2.457862e-10 3.031672e-10 ] [ 3.236614e-10 5.901118e-11 4.309357e-10 ] [ 3.135041e-10 3.239997e-10 1.121025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4073611 -3.5435262 0.7035988 ] [ 2.5010342 0.8003997 0.9643678 ] [ 0.8939827 -1.8218519 0.9101265 ] [ -3.28867 -0.8894628 1.186438 ] [ -1.73935 3.1676388 -2.5475794 ] [ 1.225642 2.2868024 -1.2169517 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.526644306433708e-10 -5.677354832832266e-09 1.127289547782935e-09 ] [ 4.007098523061231e-09 1.282381686635334e-09 1.54508754301233e-09 ] [ 1.43231818133966e-09 -2.918928520740059e-09 1.458183400270531e-09 ] [ -5.269030187526336e-09 -1.425076503231306e-09 1.900883225628711e-09 ] [ -2.78674590538848e-09 5.075116828498967e-09 -4.081672154311692e-09 ] [ 1.963694957870553e-09 3.66386134166933e-09 -1.949771562382816e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.626296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.144479260410056e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.835887 1.6598055 2.1593975 ] [ 1.6817016 2.6778579 4.3815811 ] [ 1.7410985 4.0934489 2.4175728 ] [ 3.7681329 2.9122572 3.1205808 ] [ 3.1123637 0.7614148 4.0027124 ] [ 3.2099414 3.0864285 0.7769955 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.835887e-10 1.6598055e-10 2.1593975e-10 ] [ 1.6817016e-10 2.6778579e-10 4.3815811e-10 ] [ 1.7410985e-10 4.0934489e-10 2.4175728e-10 ] [ 3.7681329e-10 2.9122572e-10 3.1205808e-10 ] [ 3.1123637e-10 7.614148e-11 4.0027124e-10 ] [ 3.2099414e-10 3.0864285e-10 7.769955e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.47e-05 -1.26e-05 2.72e-05 ] [ -2.19e-05 -2.28e-05 -3.32e-05 ] [ 3.07e-05 1.25e-05 2.8e-05 ] [ 1.2e-06 3.03e-05 -7.4e-06 ] [ 4.8e-06 1.36e-05 -1.36e-05 ] [ -1e-07 -2.1e-05 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.355199632576e-14 -2.018742542208e-14 4.357920408576e-14 ] [ -3.508766799552e-14 -3.652962695424e-14 -5.319226381056e-14 ] [ 4.918682225856e-14 2.002720776e-14 4.48609453824e-14 ] [ 1.92261194496e-15 4.854595161024e-14 -1.185610699392e-14 ] [ 7.69044777984e-15 2.178960204288e-14 -2.178960204288e-14 ] [ -1.6021766208e-16 -3.36457090368e-14 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }