{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.180338 1.724614 2.454285 ] [ 2.279675 2.151595 5.035575 ] [ 1.206438 3.673046 1.250197 ] [ 2.791298 3.409437 3.168578 ] [ 3.407643 1.775427 1.527211 ] [ 3.723971 4.511514 1.482617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.180338e-10 1.724614e-10 2.454285e-10 ] [ 2.279675e-10 2.151595e-10 5.035575e-10 ] [ 1.206438e-10 3.673046e-10 1.250197e-10 ] [ 2.791298e-10 3.409437e-10 3.168578e-10 ] [ 3.407643e-10 1.775427e-10 1.527211e-10 ] [ 3.723971e-10 4.511514e-10 1.482617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3658418 -10.1347745 3.8953658 ] [ -1.0285725 -3.4615589 5.7726621 ] [ -2.6290808 8.6317851 -8.2393647 ] [ 0.9343433 2.5048849 13.1209551 ] [ 5.8774817 -4.2265392 -4.353999 ] [ 4.2116701 6.6862025 -10.1956193 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.180137952447139e-08 -1.623769876098001e-08 6.241064014223888e-09 ] [ -1.647954812297808e-09 -5.546028741102165e-09 9.24882425639823e-09 ] [ -4.212251791954161e-09 1.382964428298979e-08 -1.320091749258481e-08 ] [ 1.496982991061121e-09 4.013268024574946e-09 2.102208750378653e-08 ] [ 9.41676376891984e-09 -6.771662293134736e-09 -6.975875404786579e-09 ] [ 6.747839368742398e-09 1.071247732743451e-08 -1.633518287703726e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.971753 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.918086276659226e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2912753 1.4547391 2.6545809 ] [ 1.7616132 1.9709657 5.1076758 ] [ 1.2627675 3.7474672 1.393382 ] [ 3.0280044 3.586642 3.493271 ] [ 3.5031429 1.9419142 1.3437258 ] [ 3.7425597 4.5439047 0.9258274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2912753e-10 1.4547391e-10 2.6545809e-10 ] [ 1.7616132e-10 1.9709657e-10 5.107675800000001e-10 ] [ 1.2627675e-10 3.7474672e-10 1.393382e-10 ] [ 3.0280044e-10 3.586642e-10 3.493271e-10 ] [ 3.5031429e-10 1.9419142e-10 1.3437258e-10 ] [ 3.7425597e-10 4.5439047e-10 9.258274e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 -2.8e-06 1.11e-05 ] [ 1.26e-05 9.5e-06 -1.83e-05 ] [ -1.45e-05 1.31e-05 -1e-05 ] [ -8.6e-06 -7.2e-06 2.94e-05 ] [ 2.25e-05 2.6e-06 -1.19e-05 ] [ -1.9e-06 -1.52e-05 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.618198387008e-14 -4.48609453824e-15 1.778416049088e-14 ] [ 2.018742542208e-14 1.52206778976e-14 -2.931983216064e-14 ] [ -2.32315610016e-14 2.098851373248e-14 -1.6021766208e-14 ] [ -1.377871893888e-14 -1.153567166976e-14 4.710399265152e-14 ] [ 3.604897396800001e-14 4.16565921408e-15 -1.906590178752e-14 ] [ -3.04413557952e-15 -2.435308463616e-14 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -19.405766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.109146459391553e-18 } }