{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4523459 0.4778673 0.765296 ] [ 0.8876723 1.989638 2.471047 ] [ 2.135329 1.164008 0.2412907 ] [ 2.495776 0.5844002 2.912252 ] [ 2.604983 2.71818 1.724062 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.523459e-11 4.778673e-11 7.65296e-11 ] [ 8.876723e-11 1.989638e-10 2.471047e-10 ] [ 2.135329e-10 1.164008e-10 2.412907e-11 ] [ 2.495776e-10 5.844002e-11 2.912252e-10 ] [ 2.604983e-10 2.71818e-10 1.724062e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.8469095 -6.5844403 0.3594807 ] [ -13.3406914 0.8558491 4.761594 ] [ 12.3362655 1.8103003 -8.598464 ] [ 6.4155932 -4.6261541 4.8354985 ] [ 10.4357422 8.5444449 -1.3581092 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.538954812201262e-08 -1.054943639662795e-08 5.759515779139638e-10 ] [ -2.137414404248475e-08 1.371221430249929e-09 7.628914647394595e-09 ] [ 1.976487633492032e-08 2.90042084118319e-09 -1.377625810909017e-08 ] [ 1.027891351828929e-08 -7.411916004303298e-09 7.747322710442049e-09 ] [ 1.671990231128775e-08 1.368970996928047e-08 -2.175930826660433e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2424681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.592829992310375e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0777632 0.697973 0.4675228 ] [ 0.6535506 1.4815399 2.6393558 ] [ 2.129593 1.3973278 -0.4553511 ] [ 2.8066586 1.1070472 3.8373366 ] [ 2.9085408 2.2502056 1.6250836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.776320000000001e-12 6.97973e-11 4.675228e-11 ] [ 6.535506e-11 1.4815399e-10 2.6393558e-10 ] [ 2.129593e-10 1.3973278e-10 -4.553511e-11 ] [ 2.8066586e-10 1.1070472e-10 3.8373366e-10 ] [ 2.9085408e-10 2.2502056e-10 1.6250836e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.8e-06 -3.1e-05 1.52e-05 ] [ -1.06e-05 3.23e-05 -1.58e-05 ] [ 7e-07 1.45e-05 1.91e-05 ] [ -3.2e-06 -3.12e-05 2.6e-06 ] [ 1.03e-05 1.54e-05 -2.1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.486094575199999e-15 -4.966747565399999e-14 2.43530848368e-14 ] [ -1.69830723204e-14 5.17503052782e-14 -2.53143908172e-14 ] [ 1.1215236438e-15 2.3231561193e-14 3.06015737094e-14 ] [ -5.1269652288e-15 -4.998791098079999e-14 4.165659248399999e-15 ] [ 1.65024193302e-14 2.46735201636e-14 -3.364570931399999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.164352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.788726390815117e-18 } }