{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.1049244e-10 1.2631377e-10 2.1363305e-10 ] [ 4.1045181e-10 2.409755e-10 1.5448564e-10 ] [ 4.1802445e-10 6.110462e-11 3.1009791e-10 ] ] "source-value" [ [ 2.1049244 1.2631377 2.1363305 ] [ 4.1045181 2.409755 1.5448564 ] [ 4.1802445 0.6110462 3.1009791 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.81590698201472e-12 6.152358223872e-14 -4.0791416765568e-13 ] [ 5.1574065423552e-13 1.7023126596e-12 -1.357844686128e-12 ] [ 1.30032654544128e-12 -1.76383624183872e-12 1.7655986361216e-12 ] ] "source-value" [ [ -0.0011334 3.84e-05 -0.0002546 ] [ 0.0003219 0.0010625 -0.0008475 ] [ 0.0008116 -0.0011009 0.001102 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.051419355102092e-18 "source-value" -6.5624435 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.937409648229709e-09 1.35065491854216e-09 -7.784751895740288e-10 ] [ -2.025664906515829e-09 -4.185084163648241e-09 3.190036191316531e-09 ] [ 8.825525828611968e-11 2.834429245106081e-09 -2.411561001742502e-09 ] ] "source-value" [ [ 1.209236 0.8430125 -0.485886 ] [ -1.2643206 -2.6121241 1.991064 ] [ 0.0550846 1.7691116 -1.505178 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.530850760645455e-19 "source-value" -5.9486892 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.112712e-10 1.214995e-10 2.179107e-10 ] [ 4.148450000000001e-10 2.569089e-10 1.416915e-10 ] [ 4.128525e-10 4.99855e-11 3.186144e-10 ] ] "source-value" [ [ 2.112712 1.214995 2.179107 ] [ 4.14845 2.569089 1.416915 ] [ 4.128525 0.499855 3.186144 ] ] } "instance-id" 1 }