{ "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" [ [ 1.735137 1.403924 2.79869 ] [ 2.045924 2.694064 4.682831 ] [ 2.274394 3.585822 2.431289 ] [ 3.715465 2.312241 1.138099 ] [ 3.875208 1.089856 3.316209 ] [ 4.61535 3.47459 2.663723 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.735137e-10 1.403924e-10 2.79869e-10 ] [ 2.045924e-10 2.694064e-10 4.682831e-10 ] [ 2.274394e-10 3.585822e-10 2.431289e-10 ] [ 3.715465e-10 2.312241e-10 1.138099e-10 ] [ 3.875208e-10 1.089856e-10 3.316209e-10 ] [ 4.615350000000001e-10 3.47459e-10 2.663723e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7515981 -2.6910547 -0.3858252 ] [ -0.1330002 0.5326678 1.8377846 ] [ -2.6929374 4.060066 -0.1882498 ] [ 0.6928036 -2.1468882 -4.7509892 ] [ 1.9543066 -1.65705 1.2173641 ] [ 2.9304255 1.902259 2.2699156 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.408546145657701e-09 -4.311544925633958e-09 -6.181601151554841e-10 ] [ -2.130898110017242e-10 8.534278958129702e-10 2.94445552018628e-09 ] [ -4.314561343557938e-09 6.504942824104973e-09 -3.016094284302758e-10 ] [ 1.109993730726075e-09 -3.439694081511394e-09 -7.611923821913296e-09 ] [ 3.131144344395137e-09 -2.65488676949664e-09 1.950432300021233e-09 ] [ 4.69505922509615e-09 3.047754896506387e-09 3.636805705509205e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0102278 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.443597632924222e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.195822 0.8575047 2.503664 ] [ 1.8630772 2.5764573 4.2086804 ] [ 2.5618719 4.1732861 2.7350772 ] [ 2.8946576 2.4543325 1.0300702 ] [ 4.0236221 1.4510299 4.0134604 ] [ 4.7224272 3.0478865 2.5398888 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.195822e-10 8.575047e-11 2.503664e-10 ] [ 1.8630772e-10 2.5764573e-10 4.208680400000001e-10 ] [ 2.5618719e-10 4.173286100000001e-10 2.7350772e-10 ] [ 2.8946576e-10 2.4543325e-10 1.0300702e-10 ] [ 4.0236221e-10 1.4510299e-10 4.0134604e-10 ] [ 4.7224272e-10 3.0478865e-10 2.5398888e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.84e-05 2.6e-05 -6.5e-06 ] [ 3.94e-05 -3.2e-05 -2.58e-05 ] [ 1.03e-05 3.91e-05 -4.4e-06 ] [ -2.91e-05 -1.77e-05 9.7e-06 ] [ -2.85e-05 2.8e-06 1.98e-05 ] [ -3.05e-05 -1.82e-05 7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.152358223872e-14 4.16565921408e-14 -1.04141480352e-14 ] [ 6.312575885952001e-14 -5.12696518656e-14 -4.133615681664e-14 ] [ 1.650241919424e-14 6.264510587328001e-14 -7.04957713152e-15 ] [ -4.662333966527999e-14 -2.835852618816e-14 1.554111322176e-14 ] [ -4.56620336928e-14 4.48609453824e-15 3.172309709184e-14 ] [ -4.88663869344e-14 -2.915961449856e-14 1.169588933184e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.567729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853354495955016e-18 } }