{ "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" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.2568312 -12.8414841 3.251541 ] [ -13.2974338 16.027718 3.124169 ] [ 14.5776785 -5.2196878 -4.4338875 ] [ -11.9492536 -11.6835429 -20.7417287 ] [ 8.4656208 -13.2728887 6.7451518 ] [ 7.8117547 20.9706273 -8.633889 ] [ 15.6484645 6.0192581 20.6886435 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.405719798093201e-08 -2.057432560139493e-08 5.209542971772653e-09 ] [ -2.13048375509957e-08 2.567923506437533e-08 5.005470531228116e-09 ] [ 2.335601567823881e-08 -8.362861761034986e-09 -7.10387089175736e-09 ] [ -1.914481475393024e-08 -1.871909928249383e-08 -3.323191279811638e-08 ] [ 1.356341972631819e-08 -2.12655119656205e-08 1.080692451770704e-08 ] [ 1.251581074776452e-08 3.359864878357023e-08 -1.383301510238229e-08 ] [ 2.507160397331876e-08 9.643914602381029e-09 3.314686093176589e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.5699044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.212832385137105e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8471454 3.0690495 2.3214098 ] [ 3.2636676 4.6818562 3.314353 ] [ 5.4218012 2.782305 1.297096 ] [ 3.3020879 1.7884327 0.9614363 ] [ 6.0203429 2.1769598 3.5036601 ] [ 4.8299289 5.0532276 1.582884 ] [ 4.565399 3.4575793 4.8636329 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8471454e-10 3.0690495e-10 2.3214098e-10 ] [ 3.2636676e-10 4.6818562e-10 3.314353e-10 ] [ 5.4218012e-10 2.782305e-10 1.297096e-10 ] [ 3.3020879e-10 1.7884327e-10 9.614363e-11 ] [ 6.0203429e-10 2.1769598e-10 3.5036601e-10 ] [ 4.8299289e-10 5.0532276e-10 1.582884e-10 ] [ 4.565399e-10 3.4575793e-10 4.8636329e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-06 -1.3e-06 1.25e-05 ] [ 1.48e-05 8.6e-06 1.01e-05 ] [ -2.63e-05 -1.3e-06 -1.06e-05 ] [ 4.1e-05 -0.0 6.4e-06 ] [ -1.09e-05 -2.1e-06 1.9e-06 ] [ 2.2e-06 -1.1e-06 -2e-07 ] [ -1.29e-05 -2.8e-06 -2.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-14 -2.08282960704e-15 2.002720776e-14 ] [ 2.371221398784e-14 1.377871893888e-14 1.618198387008e-14 ] [ -4.213724512704e-14 -2.08282960704e-15 -1.698307218048e-14 ] [ 6.56892414528e-14 0.0 1.025393037312e-14 ] [ -1.746372516672e-14 -3.36457090368e-15 3.04413557952e-15 ] [ 3.52478856576e-15 -1.76239428288e-15 -3.2043532416e-16 ] [ -2.066807840832e-14 -4.48609453824e-15 -3.220375007808e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }