{ "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" [ [ -0.856136 -4.7904144 -0.9893099 ] [ -2.03145 3.1330447 -1.0990536 ] [ -4.4410366 4.7219583 1.650726 ] [ 1.8623991 -3.4985246 1.0208374 ] [ -0.4424981 0.5438383 -0.3666977 ] [ 5.064977 1.0865411 -1.444118 ] [ 0.8437447 -1.1964434 1.2276158 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.371681083425229e-09 -7.67508995562366e-09 -1.585049192505986e-09 ] [ -3.25474169632416e-09 5.01969097026135e-09 -1.760877982926075e-09 ] [ -7.115325012637122e-09 7.565411192652513e-09 2.644754604546701e-09 ] [ 2.983892296618961e-09 -5.605254321413672e-09 1.635561815918258e-09 ] [ -7.089601105684205e-10 8.713250097556166e-10 -5.875144818411323e-10 ] [ 8.114987734289721e-09 1.740830747958315e-09 -2.313732097276454e-09 ] [ 1.35182803226391e-09 -1.916913643590463e-09 1.966857334084688e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5521211589289265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.895478716684928e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2593617 1.9792326 2.8461141 ] [ 3.073604 3.7310021 1.0942252 ] [ 2.1443217 4.4132646 3.1993674 ] [ 3.5882367 1.3904805 0.9826499 ] [ 4.8660492 2.0188326 2.9133738 ] [ 4.5925433 4.4310629 2.8548587 ] [ 3.5591705 3.0617779 4.6352942 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2593617e-10 1.9792326e-10 2.8461141e-10 ] [ 3.073604e-10 3.7310021e-10 1.0942252e-10 ] [ 2.1443217e-10 4.4132646e-10 3.1993674e-10 ] [ 3.5882367e-10 1.3904805e-10 9.826499e-11 ] [ 4.866049200000001e-10 2.0188326e-10 2.9133738e-10 ] [ 4.5925433e-10 4.4310629e-10 2.8548587e-10 ] [ 3.5591705e-10 3.0617779e-10 4.6352942e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.88e-05 1.65e-05 2.33e-05 ] [ -2.06e-05 6.2e-06 2.96e-05 ] [ 5.48e-05 -2.02e-05 2.9e-06 ] [ 7.4e-06 -4.54e-05 -6.54e-05 ] [ -4.8e-05 3.11e-05 4.42e-05 ] [ -1.33e-05 5e-06 1.42e-05 ] [ -9.2e-06 6.8e-06 -4.88e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.614268667904e-14 2.64359142432e-14 3.733071526464e-14 ] [ -3.300483838848e-14 9.93349504896e-15 4.742442797568e-14 ] [ 8.779927881984e-14 -3.236396774016e-14 4.646312200320001e-15 ] [ 1.185610699392e-14 -7.273881858432e-14 -1.0478235100032e-13 ] [ -7.69044777984e-14 4.982769290688e-14 7.081620663936001e-14 ] [ -2.130894905664e-14 8.010883104e-15 2.275090801536e-14 ] [ -1.474002491136e-14 1.089480102144e-14 -7.818621909504e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }