{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9845862 -0.8679427 -4.0286017 ] [ -0.7913304 -2.185518 3.9180463 ] [ 2.3385795 -3.0194932 -1.0569989 ] [ 0.1361533 2.6145148 4.0804286 ] [ 0.0363986 0.3013182 0.4382952 ] [ 0.9695641 4.1972157 -2.9370906 ] [ 0.2952212 -1.0400947 -0.4140789 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.781834232402313e-09 -1.390597502134028e-09 -6.454531458255136e-09 ] [ -1.267851066208312e-09 -3.501585843937575e-09 6.277402181071943e-09 ] [ 3.746817400782154e-09 -4.837761411704578e-09 -1.693498925791317e-09 ] [ 2.181416341047686e-10 4.188914487295587e-09 6.537567305763675e-09 ] [ 5.831698594985089e-11 4.827649754615385e-10 7.022263224488603e-10 ] [ 1.553412933386993e-09 6.724680866994707e-09 -4.705737892491445e-09 ] [ 4.72996504604521e-10 -1.66641541175799e-09 -6.634275327465812e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.555031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.492190700401924e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.71545 1.6534675 1.2427009 ] [ 2.3147515 0.9062546 3.357254 ] [ 4.6503589 1.4654459 3.2037604 ] [ 3.0003576 3.0454063 4.1977655 ] [ 5.2768867 3.267924 1.7823611 ] [ 2.8483052 3.6839622 1.748211 ] [ 4.3052221 4.902597 3.284998 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.71545e-10 1.6534675e-10 1.2427009e-10 ] [ 2.3147515e-10 9.062546e-11 3.357254e-10 ] [ 4.6503589e-10 1.4654459e-10 3.2037604e-10 ] [ 3.0003576e-10 3.0454063e-10 4.1977655e-10 ] [ 5.2768867e-10 3.267924e-10 1.7823611e-10 ] [ 2.8483052e-10 3.6839622e-10 1.748211e-10 ] [ 4.3052221e-10 4.902597e-10 3.284998e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0452578 0.2807978 0.0457622 ] [ 0.1360743 -0.1407368 -0.0782357 ] [ 0.0223457 0.1768426 0.2676085 ] [ 0.2772467 0.2169045 -0.5452352 ] [ -0.5807322 0.0253658 0.2182578 ] [ -0.0101067 -0.2220367 -0.0025431 ] [ 0.1099145 -0.3371373 0.0943854 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.251098906884225e-11 4.498876703320742e-10 7.331912695637376e-11 ] [ 2.180150621517255e-10 -2.254852106462054e-10 -1.253474094519226e-10 ] [ 3.580175811541056e-11 2.833330792814861e-10 4.287560822273569e-10 ] [ 4.441981809339514e-10 3.475193188463136e-10 -8.735630902772122e-10 ] [ -9.304355537857498e-10 4.064049172788864e-11 3.496875444672423e-10 ] [ -1.619271845343936e-11 -3.557420096995834e-10 -4.07449536435648e-12 ] [ 1.761024421869216e-10 -5.401535000596358e-10 1.512220812248563e-10 ] ] } "relaxed-potential-energy" { "source-value" -21.465709 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.439185710869615e-18 } }