{ "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" [ [ -28.1845247 9.6825134 -44.3539424 ] [ -4.6608542 -15.273923 5.624197 ] [ -39.2927474 -15.4375372 -11.044579 ] [ -1.3035441 37.3466618 28.8387338 ] [ 11.1018702 -14.8019102 15.8537829 ] [ 25.4793675 -23.2130584 10.7751476 ] [ 36.8604326 21.6972535 -5.69334 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.515658691473585e-08 1.551309672787189e-08 -7.106285013906188e-08 ] [ -7.467511693720762e-09 -2.447152254011518e-08 9.010957018412896e-09 ] [ -6.295392176994425e-08 -2.473366138834578e-08 -1.769536640616708e-08 ] [ -2.088507898408559e-09 5.983594889386037e-08 4.620474544850602e-08 ] [ 1.778715702814091e-08 -2.371527466100627e-08 2.540056052288876e-08 ] [ 4.082244725759899e-08 -3.719141977215743e-08 1.726368971262118e-08 ] [ 5.905692383085187e-08 3.476283257967471e-08 -9.12173631741756e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.535366276367164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.367516441062706e-18 } "relaxed-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 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -28.1845247 9.6825134 -44.3539424 ] [ -4.6608542 -15.273923 5.624197 ] [ -39.2927474 -15.4375372 -11.044579 ] [ -1.3035441 37.3466618 28.8387338 ] [ 11.1018702 -14.8019102 15.8537829 ] [ 25.4793675 -23.2130584 10.7751476 ] [ 36.8604326 21.6972535 -5.69334 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.515658691473585e-08 1.551309672787189e-08 -7.106285013906188e-08 ] [ -7.467511693720762e-09 -2.447152254011518e-08 9.010957018412896e-09 ] [ -6.295392176994425e-08 -2.473366138834578e-08 -1.769536640616708e-08 ] [ -2.088507898408559e-09 5.983594889386037e-08 4.620474544850602e-08 ] [ 1.778715702814091e-08 -2.371527466100627e-08 2.540056052288876e-08 ] [ 4.082244725759899e-08 -3.719141977215743e-08 1.726368971262118e-08 ] [ 5.905692383085187e-08 3.476283257967471e-08 -9.12173631741756e-09 ] ] } "relaxed-potential-energy" { "source-value" -8.535366276367164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.367516441062706e-18 } }