{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2311871 -3.1399116 -0.3637215 ] [ -0.4021236 -0.519581 -0.7105574 ] [ -0.609058 0.4161642 0.405888 ] [ 1.0671359 2.1091392 -2.3875942 ] [ 0.1424775 -0.0897916 0.2436283 ] [ 0.7460205 -2.205031 1.6857081 ] [ 2.2867348 3.4290118 1.1266487 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.176932429050551e-09 -5.030692956898721e-09 -5.827460837823071e-10 ] [ -6.44273030591931e-10 -8.324605308118847e-10 -1.138438454016434e-09 ] [ -9.758184883112065e-10 6.667685516539353e-10 6.503042642632704e-10 ] [ 1.709740190196367e-09 3.379213516252815e-09 -3.825347607197679e-09 ] [ 2.28274119490032e-10 -1.438620022642253e-10 3.903355664252486e-10 ] [ 1.195256603737526e-09 -3.532849116339245e-09 2.700802107313189e-09 ] [ 3.663753034529764e-09 5.493882538407325e-09 1.805090206994713e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.780197 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.00891925674183e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3977611 1.931931 4.2805836 ] [ 2.277636 2.9888653 2.1572767 ] [ 5.2503819 0.6750722 2.0087072 ] [ 5.5540428 3.018301 1.6281325 ] [ 3.6874514 1.8876977 0.645616 ] [ 4.6410956 1.1550256 4.2186167 ] [ 4.2343152 3.4683828 3.5417404 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3977611e-10 1.931931e-10 4.2805836e-10 ] [ 2.277636e-10 2.9888653e-10 2.1572767e-10 ] [ 5.2503819e-10 6.750722e-11 2.0087072e-10 ] [ 5.554042800000001e-10 3.018301e-10 1.6281325e-10 ] [ 3.6874514e-10 1.8876977e-10 6.45616e-11 ] [ 4.6410956e-10 1.1550256e-10 4.2186167e-10 ] [ 4.234315200000001e-10 3.4683828e-10 3.5417404e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.9e-06 1.68e-05 -1.88e-05 ] [ 4.3e-06 -3.64e-05 2.73e-05 ] [ -4.16e-05 1.04e-05 -8.9e-06 ] [ -8.2e-06 -2.7e-05 2.82e-05 ] [ 2.56e-05 1.35e-05 -1.73e-05 ] [ 3.61e-05 -1.19e-05 1.6e-06 ] [ -1.03e-05 3.46e-05 -1.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.45284206272e-15 2.691656722944e-14 -3.012092047104e-14 ] [ 6.889359469440001e-15 -5.831922899712e-14 4.373942174784e-14 ] [ -6.665054742528e-14 1.666263685632e-14 -1.425937192512e-14 ] [ -1.313784829056e-14 -4.32587687616e-14 4.518138070656001e-14 ] [ 4.101572149248001e-14 2.16293843808e-14 -2.771765553984e-14 ] [ 5.783857601088001e-14 -1.906590178752e-14 2.56348259328e-15 ] [ -1.650241919424e-14 5.543531107968001e-14 -1.954655477376e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.244274 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.56392557494693e-18 } }