{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0150797 -2.3704688 1.4995723 ] [ 0.1251891 1.9636648 -1.8007283 ] [ 6.482298 -1.3890498 -1.6343001 ] [ 4.1668795 6.1696812 1.3512939 ] [ -6.3426778 -2.8737411 -5.1756131 ] [ -4.2987311 -2.6719653 4.2931582 ] [ 0.8821222 1.1718791 1.4666171 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.62633697698773e-09 -3.797909722986019e-09 2.402579700053638e-09 ] [ 2.005750508514894e-10 3.146137859568283e-09 -2.885084806442542e-09 ] [ 1.038578639022493e-08 -2.225503133022373e-09 -2.618437433163863e-09 ] [ 6.676076971593603e-09 9.88491905786908e-09 2.165011512246732e-09 ] [ -1.016209016815052e-08 -4.604240842585457e-09 -8.292246375444303e-09 ] [ -6.887326524269117e-09 -4.2809603705188e-09 6.878397754105497e-09 ] [ 1.413315577172675e-09 1.877557311892949e-09 2.349779648644841e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.326442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.974913735275623e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0430408 2.126125 4.6026457 ] [ 2.3861715 3.9322119 2.9985176 ] [ 5.3881731 0.7451895 2.6138585 ] [ 4.7264344 3.1982045 2.6198511 ] [ 3.1251067 1.637885 1.7718186 ] [ 3.398486 0.390571 3.8904419 ] [ 3.6213155 3.9180399 5.1720444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0430408e-10 2.126125e-10 4.6026457e-10 ] [ 2.3861715e-10 3.9322119e-10 2.9985176e-10 ] [ 5.3881731e-10 7.451894999999999e-11 2.6138585e-10 ] [ 4.7264344e-10 3.1982045e-10 2.6198511e-10 ] [ 3.1251067e-10 1.637885e-10 1.7718186e-10 ] [ 3.398486e-10 3.90571e-11 3.8904419e-10 ] [ 3.6213155e-10 3.9180399e-10 5.1720444e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.3789505 -0.2497895 0.7420846 ] [ 0.3627301 0.7000205 -0.1996316 ] [ 0.1880238 -0.2282702 0.2908436 ] [ -0.2760889 0.5004049 -0.7455192 ] [ 0.279017 -0.6881611 0.1530065 ] [ -0.1365063 -0.4977199 -0.8427966 ] [ -0.0382251 0.4635154 0.6020127 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.07145636542617e-10 -4.00206900318543e-10 1.188950606571236e-09 ] [ 5.811576906684834e-10 1.121556488420997e-09 -3.198450849280344e-10 ] [ 3.012473389958891e-10 -3.657291806785068e-10 4.659828200684424e-10 ] [ -4.423431844867626e-10 8.017370383191066e-10 -1.194453442438373e-09 ] [ 4.47034517888778e-10 -1.102555634847737e-09 2.451434391501209e-10 ] [ -2.187072042537942e-10 -7.974351940568166e-10 -1.350309019734644e-09 ] [ -6.124336205231339e-11 7.426335433791636e-10 9.645306813112516e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.971415 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.238467465691711e-18 } }