{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.0773804 6.6053151 -22.1141961 ] [ -6.8699912 -10.6638612 33.3233443 ] [ 12.5290394 -15.2376791 -16.4426507 ] [ -9.9085024 31.0230232 -19.0418352 ] [ 28.3268346 -11.726798 24.2753377 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.857621596698815e-08 1.058288142623722e-08 -3.543084797920654e-08 ] [ -1.100693928574174e-08 -1.708538910209623e-08 5.338988316432895e-08 ] [ 2.007373400776206e-08 -2.441345320927279e-08 -2.634403053552076e-08 ] [ -1.587517089242069e-08 4.970436247757601e-08 -3.050838317456649e-08 ] [ 4.538459213738853e-08 -1.87884015924442e-08 3.889337852496485e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.955504 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.556353548188088e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1047115 0.9978358 0.8682433 ] [ 0.4272829 0.4533499 3.1590653 ] [ 1.9339067 -0.228903 0.4601895 ] [ 1.4582399 2.7890324 1.2879303 ] [ 2.6509921 1.0111692 2.4032231 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.047115e-11 9.978358000000001e-11 8.682433000000001e-11 ] [ 4.272829000000001e-11 4.533499e-11 3.1590653e-10 ] [ 1.9339067e-10 -2.28903e-11 4.601895e-11 ] [ 1.4582399e-10 2.7890324e-10 1.2879303e-10 ] [ 2.6509921e-10 1.0111692e-10 2.4032231e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.9e-05 -5.7e-06 9.1e-06 ] [ 1.28e-05 4.22e-05 -2.99e-05 ] [ -2e-07 2.06e-05 1.12e-05 ] [ -1.83e-05 -4.46e-05 2.68e-05 ] [ -1.33e-05 -1.25e-05 -1.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.04413557952e-14 -9.13240673856e-15 1.457980724928e-14 ] [ 2.050786074624e-14 6.761185339776e-14 -4.790508096192e-14 ] [ -3.2043532416e-16 3.300483838848e-14 1.794437815296e-14 ] [ -2.931983216064e-14 -7.145707728768e-14 4.293833343744e-14 ] [ -2.130894905664e-14 -2.002720776e-14 -2.771765553984e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }