{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1860509 3.95381 2.613527 ] [ 1.567846 3.644648 0.7971861 ] [ 2.293743 3.741388 3.176886 ] [ 3.786148 2.787453 1.709706 ] [ 5.865671 2.396852 2.649651 ] [ 3.786965 2.496542 4.574471 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.860509e-11 3.95381e-10 2.613527e-10 ] [ 1.567846e-10 3.644648e-10 7.971861000000001e-11 ] [ 2.293743e-10 3.741388e-10 3.176886e-10 ] [ 3.786148e-10 2.787453e-10 1.709706e-10 ] [ 5.865671e-10 2.396852e-10 2.649651e-10 ] [ 3.786965e-10 2.496542e-10 4.574471e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3931657 0.0179611 -0.4091628 ] [ 1.4411097 -0.4204758 1.0496283 ] [ 2.0912535 0.4465163 0.0783119 ] [ -1.2026125 -0.1911402 2.074713 ] [ -2.5082677 0.2254911 2.6816517 ] [ 2.5716827 -0.0783525 -5.475142 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.834274134240466e-09 2.877685450385088e-11 -6.555510722610662e-10 ] [ 2.308912269348101e-09 -6.736764963721767e-10 1.681689922790049e-09 ] [ 3.350557465866173e-09 7.15397976666119e-10 1.254694953104275e-10 ] [ -1.92679763138184e-09 -3.062403597350362e-10 3.324056663469831e-09 ] [ -4.018687867647788e-09 3.612765686184749e-10 4.296479658868576e-09 ] [ 4.120289898055821e-09 -1.25534543681232e-10 -8.772144507960155e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.003535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.044701948955453e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.046764 3.2630507 3.1213544 ] [ 1.7876056 3.7837907 0.9679972 ] [ 3.1066555 4.385232 2.8397551 ] [ 3.4710331 2.2930807 1.597337 ] [ 5.0727582 3.0821041 3.1166093 ] [ 3.0016075 2.2134348 3.8783742 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.046764e-10 3.2630507e-10 3.1213544e-10 ] [ 1.7876056e-10 3.7837907e-10 9.679972e-11 ] [ 3.1066555e-10 4.385232e-10 2.8397551e-10 ] [ 3.4710331e-10 2.2930807e-10 1.597337e-10 ] [ 5.0727582e-10 3.0821041e-10 3.1166093e-10 ] [ 3.0016075e-10 2.2134348e-10 3.8783742e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-06 3.51e-05 -3e-07 ] [ 8e-06 -1.23e-05 2.47e-05 ] [ -1.07e-05 -8.2e-06 7.3e-06 ] [ 4.12e-05 -8.5e-06 2.82e-05 ] [ -2.91e-05 1.12e-05 -3.22e-05 ] [ -6.8e-06 -1.73e-05 -2.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.16565921408e-15 5.623639939008e-14 -4.8065298624e-16 ] [ 1.28174129664e-14 -1.970677243584e-14 3.957376253376001e-14 ] [ -1.714328984256e-14 -1.313784829056e-14 1.169588933184e-14 ] [ 6.600967677696001e-14 -1.36185012768e-14 4.518138070656001e-14 ] [ -4.662333966527999e-14 1.794437815296e-14 -5.159008718975999e-14 ] [ -1.089480102144e-14 -2.771765553984e-14 -4.438029239616e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.45441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.918028397745773e-18 } }