{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1666346 -9.9915957 -0.3056127 ] [ -5.3224289 6.3689679 -3.5760707 ] [ -8.0938864 9.2589798 1.9165789 ] [ 4.6789754 -7.3017573 -0.9736708 ] [ 0.4406172 -0.1721573 -0.5446038 ] [ 11.2415998 3.9320795 -2.7105782 ] [ 1.2217576 -2.0945168 6.1939573 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.67568454353636e-09 -1.600830103502581e-08 -4.896455229595642e-10 ] [ -8.527471149450262e-09 1.020421146800567e-08 -5.72949686986789e-09 ] [ -1.296783556149108e-08 1.483452096801946e-08 3.070697905498581e-09 ] [ 7.496544995178328e-09 -1.169870483681573e-08 -1.559992592115633e-09 ] [ 7.059465765623577e-10 -2.758264011600519e-10 -8.725514759588389e-10 ] [ 1.801102837994995e-08 6.299885846026953e-09 -4.342825020890146e-09 ] [ 1.957471463004718e-09 -3.35578584883283e-09 9.923813576293492e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9211193 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.589538539462766e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2379507 1.9583785 2.8456695 ] [ 2.9202271 3.7632325 0.9510616 ] [ 2.0295829 4.5722525 3.2852327 ] [ 3.768219 1.384365 0.806067 ] [ 4.9347116 1.836908 3.0046182 ] [ 4.6328262 4.4015017 2.7881225 ] [ 3.5597695 3.1090147 4.8451118 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2379507e-10 1.9583785e-10 2.8456695e-10 ] [ 2.9202271e-10 3.7632325e-10 9.510616e-11 ] [ 2.0295829e-10 4.572252500000001e-10 3.2852327e-10 ] [ 3.768219e-10 1.384365e-10 8.06067e-11 ] [ 4.934711600000001e-10 1.836908e-10 3.0046182e-10 ] [ 4.6328262e-10 4.4015017e-10 2.7881225e-10 ] [ 3.5597695e-10 3.1090147e-10 4.8451118e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.1e-06 1.33e-05 -6.8e-06 ] [ 1.91e-05 -7.8e-06 2.39e-05 ] [ 4.7e-06 -1.46e-05 7.5e-06 ] [ 9.8e-06 8.2e-06 3.9e-06 ] [ -2.74e-05 9.1e-06 -8e-07 ] [ -2.57e-05 -2.18e-05 -5.6e-06 ] [ 1.64e-05 1.37e-05 -2.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.96674752448e-15 2.130894905664e-14 -1.089480102144e-14 ] [ 3.060157345728e-14 -1.249697764224e-14 3.829202123712e-14 ] [ 7.53023011776e-15 -2.339177866368e-14 1.2016324656e-14 ] [ 1.570133088384e-14 1.313784829056e-14 6.24848882112e-15 ] [ -4.389963940992e-14 1.457980724928e-14 -1.28174129664e-15 ] [ -4.117593915456e-14 -3.492745033344e-14 -8.972189076479999e-15 ] [ 2.627569658112e-14 2.194981970496e-14 -3.540810331968e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.496519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.6430337066383e-18 } }