{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6305471 0.004372 1.304235 ] [ 0.7154426 1.383697 2.938133 ] [ 2.486494 1.164331 0.5043625 ] [ 2.840403 0.4835428 2.252778 ] [ 2.544628 2.936148 1.00011 ] [ 2.473494 2.502288 2.980444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.305471000000001e-11 4.372e-13 1.304235e-10 ] [ 7.154426000000001e-11 1.383697e-10 2.938133e-10 ] [ 2.486494e-10 1.164331e-10 5.043625000000001e-11 ] [ 2.840403e-10 4.835428e-11 2.252778e-10 ] [ 2.544628e-10 2.936148e-10 1.00011e-10 ] [ 2.473494e-10 2.502288e-10 2.980444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.644421 -4.6716338 -3.5147443 ] [ -13.9870721 0.4728766 11.1252915 ] [ 4.0876503 -8.4137381 -22.0500683 ] [ 11.9038858 -14.8290512 9.2212346 ] [ 1.7571683 17.9580819 -7.7220324 ] [ 2.8827888 9.4834647 12.9403189 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.064553598495256e-08 -7.484782455299064e-09 -5.631241145550062e-09 ] [ -2.240975991206396e-08 7.576318330433932e-10 1.782468194088496e-08 ] [ 6.549137744666106e-09 -1.348029447735421e-08 -3.53281039173032e-08 ] [ 1.90721275254331e-08 -2.375875914128618e-08 1.477404649103204e-08 ] [ 2.815293969070881e-09 2.877201897459165e-08 -1.237205977634011e-08 ] [ 4.618736818064087e-09 1.519418542652209e-08 2.073267640727637e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.3753054 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.612188641539993e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3293033 0.2838803 1.0784533 ] [ 0.2893665 1.4395194 3.1364189 ] [ 2.4989515 0.7784042 0.2999349 ] [ 3.6496234 0.4359869 2.4112994 ] [ 2.4807546 3.1391321 0.8707278 ] [ 2.4430095 2.397456 3.1832283 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.293033000000001e-11 2.838803e-11 1.0784533e-10 ] [ 2.893665e-11 1.4395194e-10 3.1364189e-10 ] [ 2.4989515e-10 7.784042e-11 2.999349e-11 ] [ 3.6496234e-10 4.359869e-11 2.4112994e-10 ] [ 2.4807546e-10 3.1391321e-10 8.707278e-11 ] [ 2.4430095e-10 2.397456e-10 3.1832283e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.32e-05 1.19e-05 -2.22e-05 ] [ 2e-07 5.1e-06 1.95e-05 ] [ -7.3e-06 1.6e-06 5.4e-06 ] [ 7.3e-06 6e-07 1e-07 ] [ -7.7e-06 -2.37e-05 6.9e-06 ] [ -5.7e-06 4.5e-06 -9.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.114873139456e-14 1.906590178752e-14 -3.556832098176e-14 ] [ 3.2043532416e-16 8.17110076608e-15 3.12424441056e-14 ] [ -1.169588933184e-14 2.56348259328e-15 8.65175375232e-15 ] [ 1.169588933184e-14 9.6130597248e-16 1.6021766208e-16 ] [ -1.233675998016e-14 -3.797158591296e-14 1.105501868352e-14 ] [ -9.13240673856e-15 7.2097947936e-15 -1.570133088384e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.5540646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53072989357329e-18 } }