{ "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" [ [ 0.8760834 0.5811476 0.1887226 ] [ 0.0667642 0.1957144 2.535937 ] [ 2.950388 1.045755 1.267551 ] [ 1.713434 2.554048 0.6359242 ] [ 2.757437 2.623078 2.535254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.760833999999999e-11 5.811476e-11 1.887226e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 2.950388e-10 1.045755e-10 1.267551e-10 ] [ 1.713434e-10 2.554048e-10 6.359242000000001e-11 ] [ 2.757437e-10 2.623078e-10 2.535254e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.1651086 -8.9884031 -3.6563126 ] [ 0.0613086 -0.1495071 -0.9143232 ] [ 25.3763037 -40.2638344 -6.8707135 ] [ -24.5776655 26.1168767 -29.071769 ] [ 9.3051617 23.2848679 40.5131184 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.628629934681302e-08 -1.440100930514624e-08 -5.858058566056463e-09 ] [ 9.822720557397887e-11 -2.395367802636077e-10 -1.464907254895042e-09 ] [ 4.065732051046054e-08 -6.45097741394428e-08 -1.100809653791494e-08 ] [ -3.937776105794274e-08 4.184384925705626e-08 -4.657810861709819e-08 ] [ 1.490851252850358e-08 3.730647096779639e-08 6.49091711361823e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.7422092 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.393503469582671e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8556909 0.4035769 0.3948529 ] [ -0.5120539 -0.1688023 2.3584547 ] [ 3.2621217 0.8246622 1.2329909 ] [ 1.5212091 2.888767 0.6220359 ] [ 3.2371388 3.0515391 2.5550545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.556909000000001e-11 4.035769e-11 3.948529e-11 ] [ -5.120539e-11 -1.688023e-11 2.3584547e-10 ] [ 3.2621217e-10 8.246622e-11 1.2329909e-10 ] [ 1.5212091e-10 2.888767e-10 6.220359e-11 ] [ 3.2371388e-10 3.0515391e-10 2.5550545e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-06 -8.8e-06 -2.49e-05 ] [ -5.4e-06 -1.6e-06 1.05e-05 ] [ -5.7e-06 -1.01e-05 -4.6e-06 ] [ 2.6e-06 -4.2e-06 7.4e-06 ] [ 1e-05 2.47e-05 1.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4032649312e-15 -1.409915426304e-14 -3.989419785791999e-14 ] [ -8.65175375232e-15 -2.56348259328e-15 1.68228545184e-14 ] [ -9.13240673856e-15 -1.618198387008e-14 -7.370012455680001e-15 ] [ 4.16565921408e-15 -6.72914180736e-15 1.185610699392e-14 ] [ 1.6021766208e-14 3.957376253376001e-14 1.84250311392e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.137339 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.425269064692405e-18 } }