{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4550795 -3.1350104 -2.4483113 ] [ -1.1990327 -1.7758553 3.4681432 ] [ 1.1265229 3.896277 0.8334216 ] [ 1.9381379 0.9695008 -0.68298 ] [ 1.7094024 -2.8327866 -3.6149653 ] [ 3.3645376 7.0561111 -4.7839981 ] [ -2.4844885 -4.1782366 7.22869 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.137824277512403e-09 -5.022840410226994e-09 -3.922627157618164e-09 ] [ -1.921062175341932e-09 -2.84523386702506e-09 5.556577998405988e-09 ] [ 1.804888668045919e-09 6.242523968991617e-09 1.335288613790894e-09 ] [ 3.105239256849829e-09 1.553311528404307e-09 -1.09425459748932e-09 ] [ 2.738764583383521e-09 -4.538624499628303e-09 -5.7918129363808e-09 ] [ 5.390583526934437e-09 1.130513633132804e-08 -7.664809972920393e-09 ] [ -3.980589422141708e-09 -6.694273051843604e-09 1.158163821242946e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.85571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.899494154148014e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3345752 1.5320988 2.6921262 ] [ 2.3748121 2.177245 4.8337929 ] [ 0.6161957 3.7983591 2.4534887 ] [ 2.3883931 4.5018762 3.9001652 ] [ 3.5318399 1.4480523 1.7587215 ] [ 4.3081908 2.9630393 3.4429362 ] [ 6.4810611 3.2287652 4.1458903 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3345752e-10 1.5320988e-10 2.6921262e-10 ] [ 2.3748121e-10 2.177245e-10 4.8337929e-10 ] [ 6.161957e-11 3.7983591e-10 2.4534887e-10 ] [ 2.3883931e-10 4.5018762e-10 3.9001652e-10 ] [ 3.5318399e-10 1.4480523e-10 1.7587215e-10 ] [ 4.308190800000001e-10 2.9630393e-10 3.4429362e-10 ] [ 6.4810611e-10 3.2287652e-10 4.1458903e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0055853 -0.0082371 0.0041515 ] [ 0.0262708 -0.0380179 -0.0146279 ] [ 0.0065832 0.0079195 0.0098165 ] [ -0.0711143 0.1091777 -0.0108542 ] [ 0.0064216 0.0129797 0.0101282 ] [ 0.0803806 -0.0898915 0.0161026 ] [ -0.0429567 0.0060697 -0.0147167 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.948637153880198e-12 -1.31972891519214e-11 6.651436296050999e-12 ] [ 4.20904619164872e-11 -6.091139105374859e-11 -2.343647958448859e-11 ] [ 1.05474492169488e-11 1.2688437852963e-11 1.5727766927661e-11 ] [ -1.139376698032662e-10 1.749219598938618e-10 -1.73903456207628e-11 ] [ 1.02885374728944e-11 2.07957720563298e-11 1.62271653844788e-11 ] [ 1.287839191469004e-10 -1.44022060895211e-10 2.57992094666484e-11 ] [ -6.88242210137478e-11 9.724731515389798e-12 -2.35787528695878e-11 ] ] } "relaxed-potential-energy" { "source-value" -17.171713 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.751211733435404e-18 } }