{ "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" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.1966174 2.0133496 7.8039645 ] [ 77.2022057 -225.978958 67.0979174 ] [ -64.7025199 224.0535108 -76.765841 ] [ -1078.9721229 -1998.415114 -2175.9622055 ] [ 1071.6505425 1989.2403307 2180.2407511 ] [ -9.3747229 9.0868808 -2.4145865 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.723722284722482e-09 3.225741658617032e-09 1.250332947145316e-08 ] [ 1.236915690467325e-07 -3.620582033003452e-07 1.075027145626495e-07 ] [ -1.036648646906268e-07 3.589732968119203e-07 -1.229924357262501e-07 ] [ -1.728703909805324e-06 -3.201813974304167e-06 -3.486275773396505e-06 ] [ 1.716973444861137e-06 3.187114351e-06 3.493130759127852e-06 ] [ -1.501996185685838e-08 1.45587879737564e-08 -3.868594039199299e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 355.43603 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.694712974559675e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.367179 1.0689867 0.7379225 ] [ 0.9210854 0.7280505 2.8562007 ] [ -0.1044203 2.5963771 2.2770418 ] [ 2.306919 0.1238518 1.2361476 ] [ 3.0943347 1.0377818 3.0986529 ] [ 1.9876036 2.2782273 1.6446334 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.67179e-11 1.0689867e-10 7.379225e-11 ] [ 9.210854e-11 7.280505e-11 2.8562007e-10 ] [ -1.044203e-11 2.5963771e-10 2.2770418e-10 ] [ 2.306919e-10 1.238518e-11 1.2361476e-10 ] [ 3.0943347e-10 1.0377818e-10 3.0986529e-10 ] [ 1.9876036e-10 2.2782273e-10 1.6446334e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.22e-05 7.29e-05 -4.92e-05 ] [ 5.41e-05 3e-05 9.8e-06 ] [ 1.01e-05 -5.03e-05 2.45e-05 ] [ 3.83e-05 -2.19e-05 6.91e-05 ] [ -8e-05 2.43e-05 -6.41e-05 ] [ 9.8e-06 -5.51e-05 9.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.159008718975999e-14 1.1679867565632e-13 -7.882708974336e-14 ] [ 8.667775518528e-14 4.8065298624e-14 1.570133088384e-14 ] [ 1.618198387008e-14 -8.058948402624e-14 3.92533272096e-14 ] [ 6.136336457664001e-14 -3.508766799552e-14 1.1071040449728e-13 ] [ -1.28174129664e-13 3.893289188544e-14 -1.0269952139328e-13 ] [ 1.570133088384e-14 -8.827993180608e-14 1.586154854592e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }