{ "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" [ [ 0.5178768 0.1602588 0.5935764 ] [ 0.4933098 1.000634 2.761993 ] [ 1.438085 2.624316 0.8145388 ] [ 2.471365 1.192312 0.8679319 ] [ 2.522268 2.85035 2.866422 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.178768e-11 1.602588e-11 5.935764e-11 ] [ 4.933098e-11 1.000634e-10 2.761993e-10 ] [ 1.438085e-10 2.624316e-10 8.145388e-11 ] [ 2.471365e-10 1.192312e-10 8.679319e-11 ] [ 2.522268e-10 2.85035e-10 2.866422e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1670144 -6.9775828 -3.4518254 ] [ 11.2858611 8.3336229 -6.0615379 ] [ -4.9139879 4.9743231 0.966006 ] [ 1.2946881 -5.9727734 2.1477214 ] [ -2.4995468 -0.3575898 6.3996359 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.278469739221529e-09 -1.11793201239603e-08 -5.530434000527703e-09 ] [ 1.808194294898953e-08 1.335193588694732e-08 -9.711654389485428e-09 ] [ -7.873076593138729e-09 7.969744240786445e-09 1.547712241503804e-09 ] [ 2.074319022137855e-09 -9.569437981656736e-09 3.441029043421767e-09 ] [ -4.004715478549471e-09 -5.729220221167332e-10 1.025334710508756e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.227775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.959105539080935e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4261448 0.2658996 0.3535916 ] [ 0.7265819 1.0883793 2.7458652 ] [ 0.9951096 2.7091122 0.7971038 ] [ 2.7440512 0.8992317 1.1997069 ] [ 2.5510172 2.8652481 2.8081946 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.261448e-11 2.658996e-11 3.535916e-11 ] [ 7.265819e-11 1.0883793e-10 2.7458652e-10 ] [ 9.951096000000001e-11 2.7091122e-10 7.971038e-11 ] [ 2.7440512e-10 8.992317e-11 1.1997069e-10 ] [ 2.5510172e-10 2.8652481e-10 2.8081946e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.97e-05 -2.99e-05 -2.9e-05 ] [ 1.47e-05 -7.7e-06 3.13e-05 ] [ -6e-06 4.92e-05 -1.91e-05 ] [ 1.24e-05 2.7e-06 2.66e-05 ] [ -1.4e-06 -1.43e-05 -9.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.15628796898e-14 -4.790508135659999e-14 -4.6463122386e-14 ] [ 2.35519965198e-14 -1.23367600818e-14 5.014812864419999e-14 ] [ -9.613059803999999e-15 7.882709039280001e-14 -3.06015737094e-14 ] [ 1.98669902616e-14 4.3258769118e-15 4.26178984644e-14 ] [ -2.2430472876e-15 -2.29111258662e-14 -1.55411133498e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.756113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844842935926364e-18 } }