{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.905521 1.741541 1.432593 ] [ 2.475113 5.398899 1.710867 ] [ 1.47054 3.340259 2.516001 ] [ 3.027539 3.458512 0.3041981 ] [ 3.800453 3.660633 2.737021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.905521e-10 1.741541e-10 1.432593e-10 ] [ 2.475113e-10 5.398899000000001e-10 1.710867e-10 ] [ 1.47054e-10 3.340259e-10 2.516001e-10 ] [ 3.027539e-10 3.458512e-10 3.041981e-11 ] [ 3.800453e-10 3.660633e-10 2.737021e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1474497 -6.3390688 2.6974825 ] [ -0.1127883 1.6613882 -1.142585 ] [ -3.2507132 -0.5435421 1.0461619 ] [ 0.3442564 5.4918142 -4.0645846 ] [ 2.8717954 -0.2705914 1.4635253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.362404640303098e-10 -1.015630791267842e-08 4.321843432123904e-09 ] [ -1.807067788485822e-10 2.661837354043318e-09 -1.83062298935889e-09 ] [ -5.208216732875368e-09 -8.708504522152913e-10 1.676136151561044e-09 ] [ 5.515595601849575e-10 8.798856389509403e-09 -6.512182473036235e-09 ] [ 4.601123487508683e-09 -4.335352184413475e-10 2.34482603892784e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9438003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.432954785982219e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.904613 1.6362418 1.4772026 ] [ 2.4734046 5.428331 1.6892018 ] [ 1.4161152 3.3267831 2.5351541 ] [ 3.0346253 3.5512507 0.2351762 ] [ 3.8504079 3.6572374 2.7639454 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.904613e-10 1.6362418e-10 1.4772026e-10 ] [ 2.4734046e-10 5.428331e-10 1.6892018e-10 ] [ 1.4161152e-10 3.3267831e-10 2.5351541e-10 ] [ 3.0346253e-10 3.551250700000001e-10 2.351762e-11 ] [ 3.8504079e-10 3.6572374e-10 2.7639454e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.5480791 -0.8080999 0.2903994 ] [ 0.0120558 0.4845432 -0.5863752 ] [ -0.4692843 -0.7920593 0.4376093 ] [ 0.2759172 0.9442864 -0.7776633 ] [ 0.7293905 0.1713296 0.6360297 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.781195276037494e-10 -1.294718777717737e-09 4.652711332076195e-10 ] [ 1.93155210641772e-11 7.763237932035887e-10 -9.394766441970767e-10 ] [ -7.518763401630461e-10 -1.269018903202396e-09 7.011273952810961e-10 ] [ 4.420680907587047e-10 1.512913605883977e-09 -1.245953968379332e-09 ] [ 1.168612416161577e-09 2.745002818325664e-10 1.01903192387003e-09 ] ] } "relaxed-potential-energy" { "source-value" -9.7449091 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.561306566047397e-18 } }