{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.344878 2.219137 2.797465 ] [ 2.001288 4.461966 3.139291 ] [ 3.23388 2.535754 1.187329 ] [ 4.3257 4.424828 2.075195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.344878e-10 2.219137e-10 2.797465e-10 ] [ 2.001288e-10 4.461966000000001e-10 3.139291e-10 ] [ 3.23388e-10 2.535754e-10 1.187329e-10 ] [ 4.3257e-10 4.424828e-10 2.075195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9842383 0.334077 -0.7674731 ] [ 3.8472046 -4.2151859 -4.7054579 ] [ -3.4363735 3.9736298 4.9178469 ] [ -1.3950694 -0.092521 0.5550841 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.576923606547882e-09 5.35250363356818e-10 -1.229627468043545e-09 ] [ 6.163901316337316e-09 -6.75347235694626e-09 -7.538974699650707e-09 ] [ -5.505677327396799e-09 6.366456817726092e-09 7.879259392769334e-09 ] [ -2.2351475954884e-09 -1.48234984354314e-10 8.893427749249193e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.668343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.709256987809746e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2381436 2.3585455 3.114015 ] [ 1.8834687 4.541488 2.4335283 ] [ 2.7432618 2.9912493 0.9463811 ] [ 4.0408719 3.7504022 2.7053556 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2381436e-10 2.3585455e-10 3.114015e-10 ] [ 1.8834687e-10 4.541488000000001e-10 2.4335283e-10 ] [ 2.7432618e-10 2.9912493e-10 9.463811e-11 ] [ 4.0408719e-10 3.7504022e-10 2.7053556e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.6e-06 1.4e-05 -1.06e-05 ] [ 6.7e-06 -5.7e-06 4.4e-06 ] [ 4.8e-06 -1e-06 1.23e-05 ] [ -2.12e-05 -7.4e-06 -6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.53808956864e-14 2.243047287599999e-14 -1.69830723204e-14 ] [ 1.07345834478e-14 -9.1324068138e-15 7.0495771896e-15 ] [ 7.690447843199998e-15 -1.602176634e-15 1.97067725982e-14 ] [ -3.39661446408e-14 -1.18561070916e-14 -9.773277467399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.70586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516356190887524e-18 } }