{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.014789 -2.3506552 -4.108177 ] [ -5.1959167 -8.772744 10.1502792 ] [ -3.0052094 -2.661534 0.9610716 ] [ -1.9047247 6.6371188 -0.0892032 ] [ 10.0910617 7.1478145 -6.9139705 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.36945900450112e-11 -3.766164805001948e-09 -6.582025143508283e-09 ] [ -8.324776260364288e-09 -1.405548533706347e-08 1.626254002883253e-08 ] [ -4.814876241288395e-09 -4.264247550264307e-09 1.539806448434849e-09 ] [ -3.051705383400294e-09 1.063383657083215e-08 -1.429192815405466e-10 ] [ 1.61676631347903e-08 1.145206128171524e-08 -1.107740189200089e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5462681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.886101082508836e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8744816 2.6026973 1.599237 ] [ 2.3094622 2.5174356 5.1634821 ] [ 0.4300556 1.9057699 3.5685295 ] [ 1.3965511 4.363038 3.5093561 ] [ 3.7538838 3.2143762 3.1941912 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8744816e-10 2.6026973e-10 1.599237e-10 ] [ 2.3094622e-10 2.5174356e-10 5.163482100000001e-10 ] [ 4.300556e-11 1.9057699e-10 3.5685295e-10 ] [ 1.3965511e-10 4.363038000000001e-10 3.5093561e-10 ] [ 3.7538838e-10 3.2143762e-10 3.1941912e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-06 -4e-06 -7.6e-06 ] [ 4e-06 7.5e-06 2.5e-06 ] [ 8e-07 -1.6e-06 -6.7e-06 ] [ -7.2e-06 5.2e-06 9.2e-06 ] [ 5.7e-06 -7e-06 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28718284864e-15 -6.4087064832e-15 -1.217654231808e-14 ] [ 6.4087064832e-15 1.2016324656e-14 4.005441552e-15 ] [ 1.28174129664e-15 -2.56348259328e-15 -1.073458335936e-14 ] [ -1.153567166976e-14 8.33131842816e-15 1.474002491136e-14 ] [ 9.13240673856e-15 -1.12152363456e-14 4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335157330565e-18 } }