{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8923258 -1.1242271 -11.6557131 ] [ 1.9169741 -11.9014843 11.4187736 ] [ -0.4941813 3.2320394 -1.3690929 ] [ -14.4869477 4.4877156 -0.0250066 ] [ 10.1718292 5.3059563 1.6310389 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.634016776496657e-09 -1.801210376089784e-09 -1.86745110275723e-08 ] [ 3.071331085699121e-09 -1.906827989827825e-08 1.829489210012825e-08 ] [ -7.91765725296551e-10 5.17829796418446e-09 -2.193528636083272e-09 ] [ -2.321064891169233e-08 7.190113015119444e-09 -4.006498988569729e-11 ] [ 1.629706693501077e-08 8.501079134846472e-09 2.61321239319535e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.748063 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.202682511988551e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2333557 1.7995332 1.5388242 ] [ 1.9605501 1.6922039 4.1218312 ] [ 1.556635 5.4498092 2.9271773 ] [ 0.5531674 3.2670024 2.7304833 ] [ 3.1429394 3.6372343 3.019389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2333557e-10 1.7995332e-10 1.5388242e-10 ] [ 1.9605501e-10 1.6922039e-10 4.1218312e-10 ] [ 1.556635e-10 5.4498092e-10 2.9271773e-10 ] [ 5.531674e-11 3.2670024e-10 2.7304833e-10 ] [ 3.1429394e-10 3.6372343e-10 3.019389e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.16e-05 -7.1e-06 3.77e-05 ] [ 6.4e-06 6.54e-05 -8.82e-05 ] [ 1.42e-05 -1.61e-05 -1.2e-06 ] [ 5.26e-05 -6.8e-06 3.8e-05 ] [ -8.48e-05 -3.54e-05 1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.858524880128e-14 -1.137545400768e-14 6.040205860416e-14 ] [ 1.025393037312e-14 1.0478235100032e-13 -1.4131197795456e-13 ] [ 2.275090801536e-14 -2.579504359488e-14 -1.92261194496e-15 ] [ 8.427449025408001e-14 -1.089480102144e-14 6.08827115904e-14 ] [ -1.3586457744384e-13 -5.671705237632e-14 2.194981970496e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.808942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693089389278319e-18 } }