{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6837927 3.4510748 -3.0820492 ] [ 0.6183571 0.1933901 0.9956544 ] [ 1.8079873 -5.6884506 3.9988585 ] [ 0.0 0.0 0.0 ] [ -1.7425516 2.0439857 -1.9124637 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.095556677413708e-09 5.529231361192036e-09 -4.937987172395344e-09 ] [ 9.907172889256876e-10 3.098450969141741e-10 1.595214202076652e-09 ] [ 2.896714982763316e-09 -9.113902559895733e-09 6.406877598587357e-09 ] [ 0.0 0.0 0.0 ] [ -2.791875434057634e-09 3.274826101789523e-09 -3.064104628268665e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4806446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.780960645033769e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6441627 2.1482386 2.3602394 ] [ 2.2979399 1.7584533 4.4504102 ] [ 2.6600203 4.0856623 1.9569939 ] [ 4.413531 1.079857 2.965455 ] [ 3.313894 3.6958198 4.0471254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6441627e-10 2.1482386e-10 2.360239400000001e-10 ] [ 2.2979399e-10 1.7584533e-10 4.4504102e-10 ] [ 2.6600203e-10 4.0856623e-10 1.9569939e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.313894e-10 3.6958198e-10 4.0471254e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001567 1.42e-05 -0.0002168 ] [ 0.0001449 1.34e-05 0.0001497 ] [ 1.91e-05 -9.9e-06 -0.0001111 ] [ 0.0 0.0 0.0 ] [ -7.4e-06 -1.77e-05 0.0001783 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.5106107647936e-13 2.275090801536e-14 -3.4735189138944e-13 ] [ 2.3215539235392e-13 2.146916671872e-14 2.3984584013376e-13 ] [ 3.060157345728e-14 -1.586154854592e-14 -1.7800182257088e-13 ] [ 0.0 0.0 0.0 ] [ -1.185610699392e-14 -2.835852618816e-14 2.8566809148864e-13 ] ] } "relaxed-potential-energy" { "source-value" -7.5496962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.20959467457826e-18 } }