{ "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" [ [ -3.731175 -4.8228829 -4.6761803 ] [ -1.9744079 -8.4124025 5.0775729 ] [ -0.2889943 4.1745324 -1.6681535 ] [ -5.905009 4.2058775 -0.2680619 ] [ 1.9646242 -1.6557569 -0.0723111 ] [ 0.6370848 2.2686173 -3.276676 ] [ 9.2978772 4.2420151 4.8838099 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.97800135311344e-09 -7.727110227236105e-09 -7.49206675130553e-09 ] [ -3.163350177302825e-09 -1.347815461025947e-08 8.135168590787657e-09 ] [ -4.630199110044614e-10 6.688338214052115e-09 -2.672676537605693e-09 ] [ -9.460867365413587e-09 6.738558600448752e-09 -4.294825091072275e-10 ] [ 3.147674961897903e-09 -2.652814994908284e-09 -1.158551538443309e-10 ] [ 1.020722372027044e-09 3.63472559960242e-09 -5.24981368113646e-09 ] [ 1.489684147290937e-08 6.796457418300574e-09 7.824726042211587e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.095647 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899242256164966e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6039213 1.885626 3.0745085 ] [ 2.2697841 1.3743095 5.58784 ] [ 2.9666192 4.3947644 2.8775401 ] [ 1.3352056 3.5308948 4.590619 ] [ 4.5625288 1.4477492 1.8043484 ] [ 3.9157336 3.470934 0.9209844 ] [ 3.8913635 3.1981791 4.8530791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6039213e-10 1.885626e-10 3.0745085e-10 ] [ 2.2697841e-10 1.3743095e-10 5.58784e-10 ] [ 2.9666192e-10 4.3947644e-10 2.8775401e-10 ] [ 1.3352056e-10 3.5308948e-10 4.590619000000001e-10 ] [ 4.5625288e-10 1.4477492e-10 1.8043484e-10 ] [ 3.9157336e-10 3.470934e-10 9.209844e-11 ] [ 3.8913635e-10 3.1981791e-10 4.8530791e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.39e-05 -7.63e-05 -1.93e-05 ] [ 1.35e-05 -0.0001204 7.75e-05 ] [ 5.99e-05 8.68e-05 6.7e-06 ] [ -0.0001108 5.85e-05 -5.08e-05 ] [ 3.28e-05 -9.8e-06 4.16e-05 ] [ -1.99e-05 2.88e-05 -9.23e-05 ] [ 0.0001085 3.24e-05 3.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.3442261848512e-13 -1.2224607616704e-13 -3.092200878144e-14 ] [ 2.16293843808e-14 -1.9290206514432e-13 1.24168688112e-13 ] [ 9.597037958592001e-14 1.3906893068544e-13 1.073458335936e-14 ] [ -1.7752116958464e-13 9.37273323168e-14 -8.139057233664001e-14 ] [ 5.255139316223999e-14 -1.570133088384e-14 6.665054742528e-14 ] [ -3.188331475392e-14 4.614268667904e-14 -1.4788090209984e-13 ] [ 1.738361633568e-13 5.191052251392001e-14 5.84794466592e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.460479 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.758783096656937e-18 } }