{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.8226821 -22.3885839 -20.828028 ] [ -67.2728205 -109.0829178 26.8449297 ] [ 1.2973669 13.0098396 -5.8376185 ] [ -14.3217627 8.4325668 1.9408298 ] [ 9.086272 -12.5028011 4.146229 ] [ -1.7433749 14.8852096 -15.1534629 ] [ 88.7770012 107.6466869 8.8871209 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.535073154783005e-08 -3.587046599292859e-08 -3.337017979389774e-08 ] [ -1.077829411083762e-07 -1.747701020677027e-07 4.301031910671262e-08 ] [ 2.078610932905014e-09 2.08440610192079e-08 -9.352895958906126e-09 ] [ -2.294599355563275e-08 1.351046149160415e-08 3.109552156130893e-09 ] [ 1.455781268856845e-08 -2.003169578196949e-08 6.642991223013185e-09 ] [ -2.793194529082086e-09 2.384873501331248e-08 -2.427852418256587e-08 ] [ 1.422364369592299e-07 1.724690064786939e-07 1.423873744951305e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.0176985 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.444794582915685e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7963866 1.8481698 3.0078867 ] [ 2.2028393 1.34555 5.6166712 ] [ 3.0004964 4.698851 3.0145572 ] [ 1.1435143 3.5753467 4.5688281 ] [ 4.7782159 1.0824279 1.4532562 ] [ 3.7325544 3.3887993 0.9049467 ] [ 3.8911492 3.3633123 5.1427735 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7963866e-10 1.8481698e-10 3.0078867e-10 ] [ 2.2028393e-10 1.34555e-10 5.6166712e-10 ] [ 3.0004964e-10 4.698851e-10 3.0145572e-10 ] [ 1.1435143e-10 3.5753467e-10 4.5688281e-10 ] [ 4.778215900000001e-10 1.0824279e-10 1.4532562e-10 ] [ 3.7325544e-10 3.3887993e-10 9.049467e-11 ] [ 3.8911492e-10 3.3633123e-10 5.1427735e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.01e-05 3.6e-06 -1.66e-05 ] [ -1.1e-06 -2.26e-05 3.4e-06 ] [ -2.2e-06 4.73e-05 1.18e-05 ] [ 3.71e-05 -1.23e-05 -2.74e-05 ] [ -5.35e-05 1.01e-05 4.52e-05 ] [ -1.62e-05 -1.74e-05 -2.04e-05 ] [ -2.43e-05 -8.6e-06 4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.629081570339999e-14 5.767835882399999e-15 -2.65961321244e-14 ] [ -1.7623942974e-15 -3.62091919284e-14 5.4474005556e-15 ] [ -3.5247885948e-15 7.578295478819998e-14 1.89056842812e-14 ] [ 5.94407531214e-14 -1.97067725982e-14 -4.389963977159999e-14 ] [ -8.571644991899998e-14 1.61819840034e-14 7.24183838568e-14 ] [ -2.59552614708e-14 -2.78778734316e-14 -3.26844033336e-14 ] [ -3.893289220619999e-14 -1.37787190524e-14 6.408706535999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.09859 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.861019781034606e-18 } }