{ "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" [ [ 2.317023 1.146232 2.35214 ] [ 1.137751 1.512768 4.697187 ] [ 2.525224 3.828296 5.439775 ] [ 1.195151 3.273987 3.261847 ] [ 3.958209 2.788765 2.245111 ] [ 4.201729 2.884975 4.427405 ] [ 3.756146 4.818354 3.421856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.317023e-10 1.146232e-10 2.35214e-10 ] [ 1.137751e-10 1.512768e-10 4.697187e-10 ] [ 2.525224e-10 3.828296e-10 5.439775e-10 ] [ 1.195151e-10 3.273987e-10 3.261847e-10 ] [ 3.958209e-10 2.788765e-10 2.245111e-10 ] [ 4.201729000000001e-10 2.884975e-10 4.427405e-10 ] [ 3.756146e-10 4.818354e-10 3.421856e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2126226 0.5019869 0.4008275 ] [ 0.4794203 -0.4178866 0.738745 ] [ -2.1584556 -0.1287276 0.33845 ] [ 0.4761299 1.1196734 -0.5928144 ] [ -0.1736239 -1.1047076 -2.1337466 ] [ 2.3892993 -2.4885926 1.9181357 ] [ -0.8001475 2.5182541 -0.6695972 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.406589587737101e-10 8.042716751278676e-10 6.421964494737119e-10 ] [ 7.681159961969223e-10 -6.695281406656013e-10 1.183599967732896e-09 ] [ -3.458227099354837e-09 -2.062443511716941e-10 5.4225667730976e-10 ] [ 7.628441942438419e-10 1.793914544411647e-09 -9.497933721535794e-10 ] [ -2.781761533921171e-10 -1.769936689540078e-09 -3.418638917231489e-09 ] [ 3.828079478553805e-09 -3.987164882415886e-09 3.073192174061843e-09 ] [ -1.281977617691568e-09 4.034687844253746e-09 -1.072812979193142e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.933366 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.552806649584961e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4608042 1.5843242 1.880125 ] [ 1.0398343 2.4124941 5.1026011 ] [ 2.9610261 3.6473277 5.4510807 ] [ 0.9845393 3.0512678 2.8831052 ] [ 4.2551478 2.8930568 2.5163609 ] [ 4.6310345 2.2387752 4.6999054 ] [ 2.7588468 4.4261312 3.3121427 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4608042e-10 1.5843242e-10 1.880125e-10 ] [ 1.0398343e-10 2.4124941e-10 5.1026011e-10 ] [ 2.9610261e-10 3.6473277e-10 5.451080700000001e-10 ] [ 9.845393e-11 3.0512678e-10 2.8831052e-10 ] [ 4.2551478e-10 2.8930568e-10 2.5163609e-10 ] [ 4.6310345e-10 2.2387752e-10 4.6999054e-10 ] [ 2.7588468e-10 4.426131200000001e-10 3.3121427e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 -2.98e-05 3.22e-05 ] [ -9.7e-06 3.1e-06 -1.5e-06 ] [ -2.01e-05 -1.41e-05 3.2e-05 ] [ -1e-06 5.5e-06 -2.48e-05 ] [ -1.29e-05 2.65e-05 -3.23e-05 ] [ 2.64e-05 -1.35e-05 -2.6e-06 ] [ 1.97e-05 2.23e-05 -3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 -4.774486329984001e-14 5.159008718975999e-14 ] [ -1.554111322176e-14 4.96674752448e-15 -2.4032649312e-15 ] [ -3.220375007808e-14 -2.259069035328e-14 5.12696518656e-14 ] [ -1.6021766208e-15 8.8119714144e-15 -3.973398019584e-14 ] [ -2.066807840832e-14 4.24576804512e-14 -5.175030485184e-14 ] [ 4.229746278912e-14 -2.16293843808e-14 -4.16565921408e-15 ] [ 3.156287942976e-14 3.572853864384e-14 -4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }