{ "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" [ [ -13.7004486 -7.3541738 -2.1717013 ] [ -14.0725518 4.6086826 10.2811233 ] [ 11.3872333 -0.9089352 -16.0959013 ] [ 6.5642922 -8.2233584 9.5232319 ] [ 9.8214749 11.8777848 -1.5367525 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.195053844139209e-08 -1.178268532765989e-08 -3.479449050220967e-09 ] [ -2.254671348895696e-08 7.383923514407757e-09 1.647217538682215e-08 ] [ 1.824435896885523e-08 -1.456274727262172e-09 -2.578847675356433e-08 ] [ 1.05171554949398e-08 -1.31752725729393e-08 1.525789950463676e-08 ] [ 1.573573746655402e-08 1.903030911345361e-08 -2.462148927455952e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.68643447 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.099789259545239e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1938193 0.7907792 0.695887 ] [ 0.7588373 1.9175535 2.8512949 ] [ 2.6716044 0.8560844 0.394284 ] [ 2.6024406 0.2340456 2.8114997 ] [ 2.3494046 3.1356308 1.3609822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.938193e-11 7.907792e-11 6.95887e-11 ] [ 7.588373000000001e-11 1.9175535e-10 2.8512949e-10 ] [ 2.6716044e-10 8.560843999999999e-11 3.942840000000001e-11 ] [ 2.6024406e-10 2.340456e-11 2.8114997e-10 ] [ 2.349404600000001e-10 3.1356308e-10 1.3609822e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.84e-05 -6.9e-06 -1.08e-05 ] [ -6.2e-06 1.1e-06 1.37e-05 ] [ 1.1e-05 -4.8e-06 -1.48e-05 ] [ 5.7e-06 -1e-05 1.58e-05 ] [ 7.9e-06 2.06e-05 -4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.948004982272e-14 -1.105501868352e-14 -1.730350750464e-14 ] [ -9.93349504896e-15 1.76239428288e-15 2.194981970496e-14 ] [ 1.76239428288e-14 -7.69044777984e-15 -2.371221398784e-14 ] [ 9.13240673856e-15 -1.6021766208e-14 2.531439060864e-14 ] [ 1.265719530432e-14 3.300483838848e-14 -6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }