{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8135309 -1.3457015 -5.6862985 ] [ -4.7307708 -2.4739294 10.3783362 ] [ 8.429263 -7.576163 -4.4425247 ] [ 0.1158833 10.4421602 -0.1886039 ] [ 1.9991554 0.9536337 -0.060909 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.314303292278382e-09 -2.156051481875491e-09 -9.110454515590109e-09 ] [ -7.579530374123312e-09 -3.963671846189771e-09 1.662792762244231e-08 ] [ 1.350516810917447e-08 -1.213835123396999e-08 -7.117709211666534e-09 ] [ 1.856655140011526e-10 1.673018494308825e-08 -3.021767591717011e-10 ] [ 3.203000043226072e-09 1.527889618947001e-09 -9.75869757963072e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0366793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.069649820927311e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.384981 2.1206125 -0.1807511 ] [ 1.5815339 1.6805605 3.0371595 ] [ 2.9566555 0.7366033 1.1790327 ] [ 1.7549309 3.7600339 1.6658903 ] [ 4.1008648 2.9437828 1.4109764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.384981e-10 2.1206125e-10 -1.807511e-11 ] [ 1.5815339e-10 1.6805605e-10 3.0371595e-10 ] [ 2.9566555e-10 7.366033e-11 1.1790327e-10 ] [ 1.7549309e-10 3.7600339e-10 1.6658903e-10 ] [ 4.1008648e-10 2.9437828e-10 1.4109764e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 -2.5e-06 -6.4e-06 ] [ -2.9e-06 2e-06 5.7e-06 ] [ -5e-07 7.3e-06 -1.7e-06 ] [ 2.8e-06 -6.5e-06 2.5e-06 ] [ 2.4e-06 -4e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.88391791744e-15 -4.005441552e-15 -1.025393037312e-14 ] [ -4.646312200320001e-15 3.2043532416e-15 9.13240673856e-15 ] [ -8.010883104e-16 1.169588933184e-14 -2.72370025536e-15 ] [ 4.48609453824e-15 -1.04141480352e-14 4.005441552e-15 ] [ 3.84522388992e-15 -6.408706483200001e-16 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }