{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8780585 -4.9073491 -0.0297719 ] [ -2.5220173 2.5831477 -1.6740899 ] [ -4.7917737 4.7017327 0.0396234 ] [ 3.1228472 -2.6207037 2.7376768 ] [ -2.7315002 2.2395923 -2.6993201 ] [ 6.1977104 0.4543392 -2.228417 ] [ 1.6027921 -2.4507591 3.8542986 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.406804800394717e-09 -7.862439998123922e-09 -4.769984213679552e-11 ] [ -4.04071715531314e-09 4.138658853013293e-09 -2.68218769889741e-09 ] [ -7.677267794304313e-09 7.53300620919086e-09 6.348368511660673e-11 ] [ 5.003352774170741e-09 -4.198830198184057e-09 4.386241764266558e-09 ] [ -4.376345760150524e-09 3.5882224231837e-09 -4.324787556275518e-09 ] [ 9.929826705369016e-09 7.279316441529754e-10 -3.570317618793273e-09 ] [ 2.567956030622936e-09 -3.926548933232849e-09 6.175267106502171e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.46001 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.598490292493421e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3158665 2.0084204 2.816116 ] [ 2.5057745 3.7736256 0.9665498 ] [ 2.1815886 4.5302972 3.2577236 ] [ 4.1216762 1.9528937 0.997084 ] [ 4.7961742 1.5842922 3.3071311 ] [ 4.5650734 3.9989083 2.4769945 ] [ 3.5971336 3.1772157 4.7042843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3158665e-10 2.0084204e-10 2.816116e-10 ] [ 2.5057745e-10 3.7736256e-10 9.665498e-11 ] [ 2.1815886e-10 4.5302972e-10 3.2577236e-10 ] [ 4.1216762e-10 1.9528937e-10 9.97084e-11 ] [ 4.7961742e-10 1.5842922e-10 3.3071311e-10 ] [ 4.5650734e-10 3.9989083e-10 2.4769945e-10 ] [ 3.5971336e-10 3.1772157e-10 4.7042843e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 4.3e-06 -2.5e-06 ] [ 6.1e-06 -1.06e-05 -9.2e-06 ] [ 9.7e-06 -6.6e-06 1.16e-05 ] [ -6.4e-06 1.22e-05 9.1e-06 ] [ -6.5e-06 6.4e-06 9.4e-06 ] [ -5.1e-06 1.8e-06 -5e-06 ] [ 2.6e-06 -7.5e-06 -1.34e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 6.889359469440001e-15 -4.005441552e-15 ] [ 9.77327738688e-15 -1.698307218048e-14 -1.474002491136e-14 ] [ 1.554111322176e-14 -1.057436569728e-14 1.858524880128e-14 ] [ -1.025393037312e-14 1.954655477376e-14 1.457980724928e-14 ] [ -1.04141480352e-14 1.025393037312e-14 1.506046023552e-14 ] [ -8.17110076608e-15 2.88391791744e-15 -8.010883104e-15 ] [ 4.16565921408e-15 -1.2016324656e-14 -2.146916671872e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }