{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.8412834e-10 6.649775e-11 3.940411e-10 ] [ 2.5136998e-10 2.8553358e-10 3.1189399e-10 ] [ 4.822817500000001e-10 2.708539e-10 2.6949178e-10 ] [ 4.2093554e-10 5.395049e-11 2.0185505e-10 ] [ 4.789999700000001e-10 1.6793398e-10 4.810864300000001e-10 ] [ 6.2702472e-10 4.2176789e-10 1.7864216e-10 ] ] "source-value" [ [ 2.8412834 0.6649775 3.940411 ] [ 2.5136998 2.8553358 3.1189399 ] [ 4.8228175 2.708539 2.6949178 ] [ 4.2093554 0.5395049 2.0185505 ] [ 4.7899997 1.6793398 4.8108643 ] [ 6.2702472 4.2176789 1.7864216 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 8.29991576639232e-12 3.897294630096e-12 -1.87118207543232e-12 ] [ -2.59536590803392e-12 -2.47920810302592e-12 -2.52006360685632e-12 ] [ -3.47303826090816e-12 -6.12784492157376e-12 1.73339488604352e-12 ] [ -4.22317735476672e-12 4.57773904094976e-12 3.00215855205504e-12 ] [ -1.89361254812352e-12 -2.86773593356992e-12 1.77633321948096e-12 ] [ 3.88511808777792e-12 2.99975528712384e-12 -2.12080119295296e-12 ] ] "source-value" [ [ 0.0051804 0.0024325 -0.0011679 ] [ -0.0016199 -0.0015474 -0.0015729 ] [ -0.0021677 -0.0038247 0.0010819 ] [ -0.0026359 0.0028572 0.0018738 ] [ -0.0011819 -0.0017899 0.0011087 ] [ 0.0024249 0.0018723 -0.0013237 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.631488281859874e-18 "source-value" -10.182949 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.744705251342953e-09 -3.766018686494131e-09 -1.08636434926953e-09 ] [ -2.685511574514922e-09 4.249770122101097e-09 -1.911982784822289e-09 ] [ 1.728331206833481e-09 1.264834648284332e-09 -1.697269968903694e-09 ] [ -7.689572991405044e-10 -1.459252372511929e-09 -1.20934374167591e-09 ] [ 5.41435177269211e-09 7.328868560057855e-11 5.961328141891422e-09 ] [ 5.649130569044929e-11 -3.626223969799469e-10 -5.636713700233729e-11 ] ] "source-value" [ [ -2.3372612 -2.350564 -0.6780553 ] [ -1.6761645 2.6524979 -1.1933658 ] [ 1.0787395 0.7894477 -1.0593526 ] [ -0.4799454 -0.9107937 -0.754813 ] [ 3.3793726 0.0457432 3.7207684 ] [ 0.0352591 -0.2263311 -0.0351816 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.441409780639689e-18 "source-value" -8.9965723 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.638378e-10 8.784031e-11 3.89936e-10 ] [ 3.076863e-10 3.046669e-10 3.275657e-10 ] [ 5.153788e-10 2.352253e-10 2.384418e-10 ] [ 4.273122e-10 1.786437e-11 2.239865e-10 ] [ 4.529593e-10 1.652308e-10 4.599133e-10 ] [ 5.775659e-10 4.557099e-10 1.971672e-10 ] ] "source-value" [ [ 2.638378 0.8784031 3.89936 ] [ 3.076863 3.046669 3.275657 ] [ 5.153788 2.352253 2.384418 ] [ 4.273122 0.1786437 2.239865 ] [ 4.529593 1.652308 4.599133 ] [ 5.775659 4.557099 1.971672 ] ] } "instance-id" 1 }