{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9312002 0.7437347 1.637203 ] [ 0.2868751 2.587784 1.486301 ] [ 2.468756 0.0419283 1.950884 ] [ 2.101698 2.93019 0.1307908 ] [ 2.374683 2.856414 2.678274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.312002000000001e-11 7.437347e-11 1.637203e-10 ] [ 2.868751e-11 2.587784e-10 1.486301e-10 ] [ 2.468756e-10 4.19283e-12 1.950884e-10 ] [ 2.101698e-10 2.93019e-10 1.307908e-11 ] [ 2.374683e-10 2.856414e-10 2.678274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.5761427 -0.8991008 -2.6669538 ] [ -3.7166618 9.5847026 -0.2498064 ] [ 22.2388799 -10.1812517 4.6220804 ] [ 1.4074729 1.6839474 -0.8879603 ] [ -0.3535483 -0.1882974 -0.8173599 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.136443841778967e-08 -1.440518293370707e-09 -4.272931062317508e-09 ] [ -5.95474869244038e-09 1.535638654955905e-08 -4.002339771036576e-10 ] [ 3.563061374211226e-08 -1.631216357861278e-08 7.405389217349373e-09 ] [ 2.255020193368218e-09 2.697981177165051e-09 -1.42266924457963e-09 ] [ -5.664468252504221e-10 -3.016856945229516e-10 -1.309554933348577e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1346775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.226660313625534e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.410382 0.2916492 1.5753225 ] [ 0.3706203 2.6086887 1.5045703 ] [ 2.5647637 0.2761666 2.3363998 ] [ 2.1477039 3.3913804 0.1503944 ] [ 2.6697424 2.5921661 2.3167657 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.10382e-11 2.916492e-11 1.5753225e-10 ] [ 3.706203e-11 2.6086887e-10 1.5045703e-10 ] [ 2.5647637e-10 2.761666e-11 2.3363998e-10 ] [ 2.1477039e-10 3.3913804e-10 1.503944e-11 ] [ 2.6697424e-10 2.5921661e-10 2.3167657e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.4e-06 3.1e-06 6.5e-06 ] [ -6.1e-06 -1.32e-05 1.8e-06 ] [ 5e-07 6.1e-06 -7.5e-06 ] [ 9.8e-06 6.8e-06 -1.09e-05 ] [ 1.3e-06 -2.8e-06 1.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.6517538236e-15 4.9667475654e-15 1.0414148121e-14 ] [ -9.773277467399999e-15 -2.11487315688e-14 2.8839179412e-15 ] [ 8.010883169999999e-16 9.773277467399999e-15 -1.2016324755e-14 ] [ 1.57013310132e-14 1.08948011112e-14 -1.74637253106e-14 ] [ 2.0828296242e-15 -4.486094575199999e-15 1.63422016668e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.04812 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.250756961562808e-18 } }