{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.520043 -0.8625905 -0.1479879 ] [ 0.4504108 1.0180521 0.0553198 ] [ 3.7735111 0.1251737 1.4997751 ] [ 0.5584835 -0.4730155 -0.7546329 ] [ 1.8181547 0.1819944 -2.4300225 ] [ 0.4886686 2.062607 0.6425899 ] [ -4.5691856 -2.0522212 1.1349585 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.037553978010694e-09 -1.382022332424183e-09 -2.371027535412883e-10 ] [ 7.216376535158246e-10 1.631099273376344e-09 8.863209022733185e-11 ] [ 6.045831262749291e-09 2.00550375679033e-10 2.402904601677982e-09 ] [ 8.947892068025569e-10 -7.578543753760223e-10 -1.209055189666504e-09 ] [ 2.913004953337638e-09 2.915871727965236e-10 -3.893325237517969e-09 ] [ 7.829334062390669e-10 3.304660713298425e-09 1.02954251454221e-09 ] [ -7.32064234441602e-09 -3.288020827350121e-09 1.818403974278237e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.714421 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.760775062680856e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2710569 2.3539811 2.6691745 ] [ 2.3941443 1.4373748 4.4945323 ] [ 2.6309125 4.1068037 2.0250214 ] [ 1.9760121 3.8678289 4.4839329 ] [ 3.5985783 1.5940518 2.3438433 ] [ 4.2729066 2.766689 4.6937669 ] [ 4.8914573 3.5227067 2.5168498 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2710569e-10 2.3539811e-10 2.6691745e-10 ] [ 2.3941443e-10 1.4373748e-10 4.494532300000001e-10 ] [ 2.6309125e-10 4.106803700000001e-10 2.0250214e-10 ] [ 1.9760121e-10 3.8678289e-10 4.4839329e-10 ] [ 3.5985783e-10 1.5940518e-10 2.3438433e-10 ] [ 4.2729066e-10 2.766689e-10 4.6937669e-10 ] [ 4.8914573e-10 3.5227067e-10 2.5168498e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.75e-05 -6.2e-06 2.9e-06 ] [ -1.8e-05 -3.5e-06 3e-07 ] [ -2.5e-06 -5.9e-06 -1.15e-05 ] [ -2.4e-05 2.56e-05 4.37e-05 ] [ 2.32e-05 4.4e-06 -2.35e-05 ] [ 4.3e-06 7.2e-06 -1.42e-05 ] [ -3e-07 -2.17e-05 2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.8038090864e-14 -9.93349504896e-15 4.646312200320001e-15 ] [ -2.88391791744e-14 -5.6076181728e-15 4.8065298624e-16 ] [ -4.005441552e-15 -9.45284206272e-15 -1.84250311392e-14 ] [ -3.84522388992e-14 4.101572149248001e-14 7.001511832895999e-14 ] [ 3.717049760256e-14 7.04957713152e-15 -3.76511505888e-14 ] [ 6.889359469440001e-15 1.153567166976e-14 -2.275090801536e-14 ] [ -4.8065298624e-16 -3.476723267136e-14 3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -32.196266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.158410466225794e-18 } }