{ "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" [ [ -7.5027978 -5.9686987 -7.7970635 ] [ -0.4753885 -17.8268487 10.751615 ] [ 0.047861 7.2176642 -3.619581 ] [ -12.0839724 9.457217 -2.4706659 ] [ 2.8625722 -2.6493267 0.0785564 ] [ 1.3713731 3.8205757 -6.4672433 ] [ 15.7803524 5.9494172 9.5243823 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.202080722574967e-08 -9.562909513739353e-09 -1.249227285059302e-08 ] [ -7.616563404971808e-10 -2.856176020967887e-08 1.722598618884259e-08 ] [ 7.66817752481088e-11 1.156397283802514e-08 -5.799208055291885e-09 ] [ -1.936065806567247e-08 1.515213197523231e-08 -3.958443142787791e-09 ] [ 4.586346254192022e-09 -4.244689299601216e-09 1.258612274942131e-10 ] [ 2.19718191921402e-09 6.121237064536594e-09 -1.036166601628544e-08 ] [ 2.528291168326517e-08 9.532017145225398e-09 1.525974264862133e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.330713 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.616468656959463e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6578458 1.9559233 3.0683484 ] [ 2.2978897 1.3633781 5.530222 ] [ 2.9284884 4.490332 2.9063146 ] [ 1.3269196 3.5125929 4.5796915 ] [ 4.5741811 1.2996019 1.7196841 ] [ 3.8988622 3.4208373 1.0318502 ] [ 3.8609693 3.2597915 4.8728087 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6578458e-10 1.9559233e-10 3.0683484e-10 ] [ 2.2978897e-10 1.3633781e-10 5.530222e-10 ] [ 2.9284884e-10 4.490332e-10 2.9063146e-10 ] [ 1.3269196e-10 3.5125929e-10 4.5796915e-10 ] [ 4.5741811e-10 1.2996019e-10 1.7196841e-10 ] [ 3.8988622e-10 3.4208373e-10 1.0318502e-10 ] [ 3.8609693e-10 3.2597915e-10 4.8728087e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0318241 0.0295605 -0.0352542 ] [ 0.0009261 -0.0030226 0.0057639 ] [ 0.0013064 -0.0083184 0.0055082 ] [ -0.0023025 0.0017881 -0.0047852 ] [ -0.007257 -0.0036836 -0.0056547 ] [ -0.0191386 -0.0221761 0.0348311 ] [ -0.0053585 0.0058521 -0.0004091 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.098782899800128e-11 4.73611419991584e-11 -5.648345502500736e-11 ] [ 1.48377576852288e-12 -4.84273905403008e-12 9.23478582462912e-12 ] [ 2.09308353741312e-12 -1.332754600246272e-11 8.825109262690562e-12 ] [ -3.689011669392e-12 2.86485201565248e-12 -7.66673556585216e-12 ] [ -1.16269957371456e-11 -5.90177780037888e-12 -9.05982813763776e-12 ] [ -3.066341747484288e-11 -3.553002896052288e-11 5.580557409674687e-11 ] [ -8.585263422556802e-12 9.376097802583681e-12 -6.554504555692801e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.972551 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.001043737393566e-18 } }