{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2791536 -4.8172596 -3.4551166 ] [ -3.6991437 4.6823184 -7.3408946 ] [ -9.5008163 2.5187244 8.4334211 ] [ 4.8203592 -2.0312884 -4.2719424 ] [ 2.0915529 -9.1216132 -0.537278 ] [ 4.7448429 9.5559291 0.942368 ] [ 3.8223585 -0.7868107 6.2294426 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.651606613132155e-09 -7.71810070744436e-09 -5.535707038657986e-09 ] [ -5.926681553119609e-09 7.501901071621661e-09 -1.176140970387697e-08 ] [ -1.522198575437556e-08 4.035441347918508e-09 1.351183011978142e-08 ] [ 7.723066814098192e-09 -3.254482784582239e-09 -6.844406238684242e-09 ] [ 3.35103715754644e-09 -1.461443541302068e-08 -8.608142504701824e-10 ] [ 7.602076363748873e-09 1.531028619404239e-08 1.509839977790054e-09 ] [ 6.124093425016157e-09 -1.260609708535283e-09 9.980667294335566e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 7.3321773 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.174744304962047e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.387035 2.6171605 1.2806324 ] [ 2.8523677 4.6325718 1.0002351 ] [ 2.6916977 3.3717563 4.4608069 ] [ 5.5834668 2.5496956 1.7585624 ] [ 4.5832428 1.130587 2.8096682 ] [ 4.3303503 5.2708894 2.3725292 ] [ 4.6378906 3.3227256 4.9958618 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.387035e-10 2.6171605e-10 1.2806324e-10 ] [ 2.8523677e-10 4.6325718e-10 1.0002351e-10 ] [ 2.6916977e-10 3.3717563e-10 4.4608069e-10 ] [ 5.5834668e-10 2.5496956e-10 1.7585624e-10 ] [ 4.5832428e-10 1.130587e-10 2.8096682e-10 ] [ 4.3303503e-10 5.2708894e-10 2.3725292e-10 ] [ 4.637890600000001e-10 3.3227256e-10 4.995861800000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.0830412 2.7892704 0.5594264 ] [ -0.4314151 1.1995729 -0.7009281 ] [ -0.4867369 -0.9860089 2.0783311 ] [ 1.5707443 -1.2493519 0.7184105 ] [ 0.3162884 -0.6792823 -0.7586213 ] [ -1.9599551 -1.8416428 -2.1374886 ] [ -0.0919668 0.7674426 0.24087 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.735223290003177e-09 4.468903823969464e-09 8.962998991383092e-10 ] [ -6.91203187080094e-10 1.921927655325256e-09 -1.123010614681765e-09 ] [ -7.798384816606675e-10 -1.579760407480725e-09 3.329853498701548e-09 ] [ 2.516609794714862e-09 -2.00168240533206e-09 1.151020507237238e-09 ] [ 5.067498799102388e-10 -1.088330219983252e-09 -1.215445310900903e-09 ] [ -3.140194239037726e-09 -2.950637038024651e-09 -3.424634262146523e-09 ] [ -1.473470568497894e-10 1.229578591525966e-09 3.85916282652096e-10 ] ] } "relaxed-potential-energy" { "source-value" -21.973835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.520596470631677e-18 } }