{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1455198 -0.9737481 -1.6585395 ] [ 0.8313544 -1.6622694 0.644626 ] [ -1.3312108 1.9439578 -1.4691473 ] [ -0.2254283 -1.0947251 0.912763 ] [ 0.2760857 0.4618747 0.1233269 ] [ 0.9836592 0.4756957 -1.3124192 ] [ 0.6110596 0.8492144 2.7593902 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.835325057344353e-09 -1.560116453221895e-09 -2.657273233466043e-09 ] [ 1.33197659425309e-09 -2.663249192093199e-09 1.032804714868884e-09 ] [ -2.132834838688447e-09 3.114563764642045e-09 -2.353833475964188e-09 ] [ -3.611759549023421e-10 -1.753942975873313e-09 1.462407550979742e-09 ] [ 4.423380575215337e-10 7.400048521757598e-10 1.975914775236546e-10 ] [ 1.575995786059132e-09 7.621485354342737e-10 -2.102727376252972e-09 ] [ 9.790254131013864e-10 1.360591468936329e-09 4.421030502528586e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.411124 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.430440258047661e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8956573 3.017099 2.6332383 ] [ 4.7750185 1.4828161 2.1034283 ] [ 3.3810625 2.9152743 0.8502058 ] [ 3.28087 1.5941754 3.8785325 ] [ 5.7392261 3.3306454 3.128968 ] [ 4.3545735 4.753925 1.8834762 ] [ 3.5975351 3.9966738 4.0652902 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8956573e-10 3.017099e-10 2.6332383e-10 ] [ 4.7750185e-10 1.4828161e-10 2.1034283e-10 ] [ 3.3810625e-10 2.9152743e-10 8.502058e-11 ] [ 3.28087e-10 1.5941754e-10 3.8785325e-10 ] [ 5.7392261e-10 3.3306454e-10 3.128968e-10 ] [ 4.3545735e-10 4.753925e-10 1.8834762e-10 ] [ 3.5975351e-10 3.9966738e-10 4.0652902e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.69e-05 -3.73e-05 -2.86e-05 ] [ 3.22e-05 -4.37e-05 -1.15e-05 ] [ 1.6e-06 6.02e-05 2.56e-05 ] [ -7.18e-05 -1.1e-06 3.96e-05 ] [ 2.61e-05 1.23e-05 -1.21e-05 ] [ -3.76e-05 2.1e-06 -1.7e-05 ] [ 3.25e-05 7.5e-06 4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.70767851146e-14 -5.97611884482e-14 -4.58222517324e-14 ] [ 5.159008761479998e-14 -7.001511890579999e-14 -1.8425031291e-14 ] [ 2.5634826144e-15 9.645103336679999e-14 4.10157218304e-14 ] [ -1.150362823212e-13 -1.7623942974e-15 6.34461947064e-14 ] [ 4.18168101474e-14 1.97067725982e-14 -1.93863372714e-14 ] [ -6.024184143839999e-14 3.364570931399999e-15 -2.723700277799999e-14 ] [ 5.207074060499999e-14 1.2016324755e-14 6.568924199399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993289292598e-18 } }