{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6788005 -9.0202015 2.6065726 ] [ -4.1511379 9.4744582 -0.9480555 ] [ 0.2528683 -0.6677153 3.9571744 ] [ 3.1554447 -2.3588164 -9.8891087 ] [ 8.4216253 2.572275 4.2734172 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.230279463688735e-08 -1.445195595820509e-08 4.17618968013787e-09 ] [ -6.650856093096809e-09 1.517975542278685e-08 -1.518952357320854e-09 ] [ 4.051396784014406e-10 -1.069797843010458e-09 6.340092308108268e-09 ] [ 5.05557972656727e-09 -3.77924048883962e-09 -1.584409875968988e-08 ] [ 1.349293116479779e-08 4.12123886726832e-09 6.846769128764598e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.2484549 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.00111283569032e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6767539 0.6501078 1.9854069 ] [ 1.7080282 3.218711 1.5627762 ] [ 3.0014692 2.2091642 3.5408319 ] [ 3.577857 1.7230664 0.629146 ] [ 5.1244618 2.0025276 2.4421211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6767539e-10 6.501078e-11 1.9854069e-10 ] [ 1.7080282e-10 3.218711e-10 1.5627762e-10 ] [ 3.0014692e-10 2.2091642e-10 3.5408319e-10 ] [ 3.577857e-10 1.7230664e-10 6.29146e-11 ] [ 5.1244618e-10 2.0025276e-10 2.4421211e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 -1.6e-06 -1.1e-06 ] [ 5.7e-06 8e-07 1.5e-06 ] [ 7e-07 -1.2e-06 2.3e-06 ] [ 2.6e-06 -2.6e-06 1.4e-06 ] [ -7e-06 4.5e-06 -4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 -2.56348259328e-15 -1.76239428288e-15 ] [ 9.13240673856e-15 1.28174129664e-15 2.4032649312e-15 ] [ 1.12152363456e-15 -1.92261194496e-15 3.68500622784e-15 ] [ 4.16565921408e-15 -4.16565921408e-15 2.24304726912e-15 ] [ -1.12152363456e-14 7.2097947936e-15 -6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.750145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.722363098921002e-18 } }