{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7981543 -0.1095028 -5.5145942 ] [ -4.657406 -4.4478806 4.8414907 ] [ 5.3694661 1.8063292 -4.1505749 ] [ 1.4970559 5.5772033 5.5515723 ] [ 1.5666217 1.2857222 0.908306 ] [ 1.6329077 -0.9220824 0.1274634 ] [ 0.389509 -3.1897889 -1.7636633 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.289667339786625e-09 -1.754428275175752e-10 -8.835353973231922e-09 ] [ -7.461987068251404e-09 -7.1262903681419e-09 7.756923273268302e-09 ] [ 8.602833122475107e-09 2.894058437551913e-09 -6.649954122446885e-09 ] [ 2.39854798277184e-09 8.935664810327691e-09 8.894599421021638e-09 ] [ 2.510004682057358e-09 2.059954066655075e-09 1.455266649722004e-09 ] [ 2.616206562418682e-09 -1.477338875902641e-09 2.042188811701956e-10 ] [ 6.24062218532706e-10 -5.110605242972562e-09 -2.825700129503332e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.655879 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.989001342053128e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6729382 1.9154632 1.9285955 ] [ 2.4740925 0.4871582 3.888212 ] [ 4.151094 1.3050295 2.1438311 ] [ 3.076485 3.0041356 3.7582956 ] [ 5.4295495 3.317227 2.8266456 ] [ 3.415718 3.548469 1.2609523 ] [ 3.8914548 5.3475751 3.0105189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6729382e-10 1.9154632e-10 1.9285955e-10 ] [ 2.4740925e-10 4.871582e-11 3.888212e-10 ] [ 4.151094e-10 1.3050295e-10 2.1438311e-10 ] [ 3.076485e-10 3.0041356e-10 3.7582956e-10 ] [ 5.4295495e-10 3.317227e-10 2.8266456e-10 ] [ 3.415718e-10 3.548469e-10 1.2609523e-10 ] [ 3.8914548e-10 5.3475751e-10 3.0105189e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.88e-05 4.01e-05 6.32e-05 ] [ -6.43e-05 1.97e-05 -3.6e-05 ] [ 9.51e-05 -9.49e-05 -1.22e-05 ] [ -4.09e-05 -1e-07 2.68e-05 ] [ 7.63e-05 1.44e-05 -7.31e-05 ] [ 2.42e-05 -9.19e-05 -6.73e-05 ] [ -6.16e-05 0.0001127 9.86e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.614268705919999e-14 6.42472830234e-14 1.012575632688e-13 ] [ -1.030199575662e-13 3.15628796898e-14 -5.7678358824e-14 ] [ 1.523669978934e-13 -1.520465625666e-13 -1.95465549348e-14 ] [ -6.552902433059999e-14 -1.602176634e-16 4.293833379119999e-14 ] [ 1.222460771742e-13 2.30713435296e-14 -1.171191119454e-13 ] [ 3.877267454279999e-14 -1.472400326646e-13 -1.078264874682e-13 ] [ -9.86940806544e-14 1.805653066518e-13 1.579746161124e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.522289 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.928903844799523e-18 } }