{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.802797 -5.6550743 -25.705554 ] [ -18.2468926 4.1525672 24.2539865 ] [ -7.3477179 1.0675364 -4.3503446 ] [ -0.6646551 -75.9710998 -83.2759233 ] [ 24.0842236 72.988304 86.8406732 ] [ 6.9778391 3.4177665 2.2371622 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.694929067848379e-09 -9.060427832346925e-09 -4.118483764351193e-08 ] [ -2.923474472596852e-08 6.653146084140918e-09 3.885917013149882e-08 ] [ -1.177234183561367e-08 1.710381861932997e-09 -6.970020410543527e-09 ] [ -1.064894862115486e-09 -1.217191199560236e-07 -1.33422737386794e-07 ] [ 3.858717998203961e-08 1.169401542606431e-07 1.391340963355731e-07 ] [ 1.117973066972411e-08 5.475865581653443e-09 3.584328973777494e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 36.196219 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.799273584315676e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2695648 -0.8957869 1.5461896 ] [ -1.6618028 0.1335841 1.7628873 ] [ 0.4163536 4.1605912 0.6074554 ] [ 2.4254904 -0.4913144 1.7706797 ] [ 3.2939246 1.5204403 1.9837858 ] [ 2.2476315 3.4146922 1.5790218 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.695648e-11 -8.957869000000001e-11 1.5461896e-10 ] [ -1.6618028e-10 1.335841e-11 1.7628873e-10 ] [ 4.163536e-11 4.1605912e-10 6.074554e-11 ] [ 2.4254904e-10 -4.913144e-11 1.7706797e-10 ] [ 3.2939246e-10 1.5204403e-10 1.9837858e-10 ] [ 2.2476315e-10 3.414692200000001e-10 1.5790218e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.5035717 -0.0693497 0.0856825 ] [ -0.2022066 -0.0685947 -0.0302592 ] [ 0.3523769 0.0200637 0.2037023 ] [ -0.4695409 -0.1783254 -0.0111472 ] [ 0.1041977 0.0529793 -0.0168959 ] [ -0.2883987 0.2432267 -0.2310826 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.068108046365113e-10 -1.111104679994938e-10 1.37278498311696e-10 ] [ -3.239706870914572e-10 -1.099008246507897e-10 -4.848058280411136e-11 ] [ 5.645700308899795e-10 3.214559106674496e-11 3.263670626631879e-10 ] [ -7.522874524893907e-10 -2.857087867748083e-10 -1.785978322738176e-11 ] [ 1.669431188811322e-10 8.488219584634944e-11 -2.707021596737472e-11 ] [ -4.62065654609113e-10 3.896921322943354e-10 -3.702351391936781e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.400852 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.147053177320092e-18 } }