{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2030889 2.7780001 -1.4367865 ] [ 1.2549585 -1.5126167 0.3879768 ] [ -0.2380402 1.2068759 0.8789062 ] [ -0.0386598 -2.9776606 -0.632189 ] [ 2.1114054 -0.283608 -0.2927452 ] [ -0.9014025 0.0941362 0.9282092 ] [ -0.9851726 0.6948731 0.1666285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.927560908323989e-09 4.450846812800062e-09 -2.301985739381059e-09 ] [ 2.010665168774237e-09 -2.423479112971647e-09 6.216073583727975e-10 ] [ -3.813824432505561e-10 1.933628351186959e-09 1.408162965516169e-09 ] [ -6.193982772480385e-11 -4.770738197997301e-09 -1.012878435726931e-09 ] [ 3.382844368910873e-09 -4.543901070718465e-10 -4.690295152914202e-10 ] [ -1.444206011430672e-09 1.50822818810953e-10 1.487155079451471e-09 ] [ -1.57842050717275e-09 1.113309435242821e-09 2.669682870589728e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.314646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.254765088102824e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8613471 3.8320092 3.0234376 ] [ 5.5511098 2.408937 1.1703522 ] [ 3.5338164 1.0609551 1.1188617 ] [ 3.1262297 1.4487859 3.3966409 ] [ 5.1166056 2.8223682 3.5987914 ] [ 4.9344748 4.6710441 1.9631973 ] [ 3.2958217 3.4185209 0.5950058 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8613471e-10 3.8320092e-10 3.0234376e-10 ] [ 5.5511098e-10 2.408937e-10 1.1703522e-10 ] [ 3.5338164e-10 1.0609551e-10 1.1188617e-10 ] [ 3.1262297e-10 1.4487859e-10 3.3966409e-10 ] [ 5.1166056e-10 2.8223682e-10 3.5987914e-10 ] [ 4.9344748e-10 4.6710441e-10 1.9631973e-10 ] [ 3.2958217e-10 3.4185209e-10 5.950058e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.47e-05 -2.63e-05 2.63e-05 ] [ -1e-06 1.32e-05 2.7e-06 ] [ -3.67e-05 -5.4e-06 -8.1e-06 ] [ 2.29e-05 0.0 1.08e-05 ] [ -3.4e-06 -5e-07 2.89e-05 ] [ 2.98e-05 1.98e-05 -1.75e-05 ] [ 1.3e-05 -1e-06 -4.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.957376253376001e-14 -4.213724512704e-14 4.213724512704e-14 ] [ -1.6021766208e-15 2.114873139456e-14 4.32587687616e-15 ] [ -5.879988198335999e-14 -8.65175375232e-15 -1.297763062848e-14 ] [ 3.668984461632e-14 0.0 1.730350750464e-14 ] [ -5.44740051072e-15 -8.010883104e-16 4.630290434112001e-14 ] [ 4.774486329984001e-14 3.172309709184e-14 -2.8038090864e-14 ] [ 2.08282960704e-14 -1.6021766208e-15 -6.921403001856e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.563325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.615043180251216e-18 } }