{ "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" [ [ 1.697876 3.711698 1.143091 ] [ 3.423522 2.241155 2.183353 ] [ 3.951754 3.941629 0.5726112 ] [ 3.96365 5.193256 2.218192 ] [ 5.084028 3.36384 3.521791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.697876e-10 3.711698e-10 1.143091e-10 ] [ 3.423522e-10 2.241155e-10 2.183353e-10 ] [ 3.951754000000001e-10 3.941629e-10 5.726112e-11 ] [ 3.96365e-10 5.193256e-10 2.218192e-10 ] [ 5.084028e-10 3.36384e-10 3.521791e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6877385 -0.4009967 0.6013923 ] [ -0.2339193 0.2654418 0.1062196 ] [ 0.0481042 -2.4334199 -4.1304859 ] [ 0.3509305 2.2320336 3.9149603 ] [ -0.8528539 0.3369413 -0.4920863 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.101878545924061e-09 -6.424675377579514e-10 9.635366829891398e-10 ] [ -3.747800336139014e-10 4.252846461430694e-10 1.701825597907277e-10 ] [ 7.707142460228735e-11 -3.898768472369474e-09 -6.617767941524047e-09 ] [ 5.622526426256545e-10 3.576112050760058e-09 6.272457864020155e-09 ] [ -1.366422579538101e-09 5.398394734419591e-10 -7.88409165275975e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.887048399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.227738069172301e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0352765 3.8697173 1.6129874 ] [ 3.5742957 2.1050388 1.9648515 ] [ 3.9436174 3.7797606 0.332253 ] [ 3.8804679 5.231872 2.2014385 ] [ 4.6871725 3.4651893 3.5275077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0352765e-10 3.8697173e-10 1.6129874e-10 ] [ 3.5742957e-10 2.1050388e-10 1.9648515e-10 ] [ 3.9436174e-10 3.7797606e-10 3.322530000000001e-11 ] [ 3.8804679e-10 5.231872000000001e-10 2.2014385e-10 ] [ 4.687172500000001e-10 3.4651893e-10 3.5275077e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.57e-05 -1.03e-05 1.6e-05 ] [ -1.12e-05 -5e-07 -7.2e-06 ] [ 1.7e-06 -0.0 3.2e-06 ] [ -3.3e-06 9.3e-06 -5.2e-06 ] [ -1.28e-05 1.5e-06 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.117593915456e-14 -1.650241919424e-14 2.56348259328e-14 ] [ -1.794437815296e-14 -8.010883104e-16 -1.153567166976e-14 ] [ 2.72370025536e-15 0.0 5.126965186560001e-15 ] [ -5.28718284864e-15 1.490024257344e-14 -8.33131842816e-15 ] [ -2.050786074624e-14 2.4032649312e-15 -1.073458335936e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.092110399234951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.158460232186793e-19 } }