{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.007849 1.586086 2.268554 ] [ 2.12772 3.766083 1.838374 ] [ 4.424479 1.287894 2.441313 ] [ 3.363204 2.429439 0.4572432 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007849e-10 1.586086e-10 2.268554e-10 ] [ 2.12772e-10 3.766083e-10 1.838374e-10 ] [ 4.424479e-10 1.287894e-10 2.441313e-10 ] [ 3.363204e-10 2.429439e-10 4.572432e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7078778 -1.9595741 1.5657308 ] [ -1.2864146 2.7913435 0.283411 ] [ 0.2463122 -0.5756493 -0.0922683 ] [ 1.7479802 -0.25612 -1.7568735 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.134145261543338e-09 -3.139583809745201e-09 2.508577282226481e-09 ] [ -2.061063396775784e-09 4.472225296322045e-09 4.540744782775489e-10 ] [ 3.946356482578138e-10 -9.222918502398855e-10 -1.478301131009607e-10 ] [ 2.800573010061308e-09 -4.10349476119296e-10 -2.814821647403069e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.0418991 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.288454272485256e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0130218 1.6692924 3.027235 ] [ 1.8532993 3.524412 1.4853697 ] [ 4.1083066 1.010315 2.0173455 ] [ 3.9486243 2.8654827 0.4755339 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0130218e-10 1.6692924e-10 3.027235e-10 ] [ 1.8532993e-10 3.524412e-10 1.4853697e-10 ] [ 4.1083066e-10 1.010315e-10 2.0173455e-10 ] [ 3.9486243e-10 2.8654827e-10 4.755339000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.2e-05 -6.98e-05 7.68e-05 ] [ -2.47e-05 6.76e-05 -1e-06 ] [ 4.41e-05 -3.44e-05 3.8e-05 ] [ 5.26e-05 3.67e-05 -0.0001138 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.153567166976e-13 -1.1183192813184e-13 1.2304716447744e-13 ] [ -3.957376253376001e-14 1.0830713956608e-13 -1.6021766208e-15 ] [ 7.065598897728e-14 -5.511487575552001e-14 6.08827115904e-14 ] [ 8.427449025408001e-14 5.879988198335999e-14 -1.8232769944704e-13 ] ] } "relaxed-potential-energy" { "source-value" -10.363135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.660357261519421e-18 } }