{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7298468 -2.0038467 2.6053702 ] [ -2.3236392 2.774762 -1.779417 ] [ 6.5479773 -2.9678259 0.0788566 ] [ 4.7162431 6.3493194 -0.0217269 ] [ -5.6585573 -1.1526345 -7.1858903 ] [ -3.2644963 -3.9688718 4.4709393 ] [ 1.7123192 0.9690975 1.8318681 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.771520100525693e-09 -3.210516334407231e-09 4.17426322296902e-09 ] [ -3.722880401414416e-09 4.44565880468425e-09 -2.850940316054074e-09 ] [ 1.049101614358911e-08 -4.754981271584719e-09 1.263422009157773e-10 ] [ 7.556254432829316e-09 1.017273110067188e-08 -3.481033122245952e-11 ] [ -9.066008213517173e-09 -1.846724048227498e-09 -1.15130654382935e-08 ] [ -5.230299650548102e-09 -6.358833608912413e-09 7.163234419475918e-09 ] [ 2.74343778958696e-09 1.552665357775728e-09 2.934976242209317e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.2562282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.322793579802967e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3076448 2.3209507 4.6519234 ] [ 2.541933 3.440596 2.4970771 ] [ 5.2708639 1.3250992 3.0756791 ] [ 4.8047734 3.5503272 3.0792933 ] [ 2.3693979 1.3491025 1.5542696 ] [ 3.2050885 0.4837917 3.5157441 ] [ 4.1890265 3.4783595 5.2951914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3076448e-10 2.3209507e-10 4.651923400000001e-10 ] [ 2.541933e-10 3.440596e-10 2.4970771e-10 ] [ 5.2708639e-10 1.3250992e-10 3.0756791e-10 ] [ 4.8047734e-10 3.5503272e-10 3.0792933e-10 ] [ 2.3693979e-10 1.3491025e-10 1.5542696e-10 ] [ 3.2050885e-10 4.837917e-11 3.5157441e-10 ] [ 4.1890265e-10 3.4783595e-10 5.2951914e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 8.8e-06 -8e-07 ] [ 3.6e-06 -9e-06 -4.1e-06 ] [ -2.11e-05 5.6e-06 -1.17e-05 ] [ 8.9e-06 1.37e-05 5e-06 ] [ 7.7e-06 1.16e-05 2.1e-06 ] [ 1e-06 -3e-05 1.18e-05 ] [ -4.7e-06 -6e-07 -2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.2097947936e-15 1.409915426304e-14 -1.28174129664e-15 ] [ 5.76783583488e-15 -1.44195895872e-14 -6.568924145279999e-15 ] [ -3.380592669888e-14 8.972189076479999e-15 -1.874546646336e-14 ] [ 1.425937192512e-14 2.194981970496e-14 8.010883104e-15 ] [ 1.233675998016e-14 1.858524880128e-14 3.36457090368e-15 ] [ 1.6021766208e-15 -4.8065298624e-14 1.890568412544e-14 ] [ -7.53023011776e-15 -9.6130597248e-16 -3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }