{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8005336 -1.2989706 -1.0125199 ] [ -3.113077 -0.6102747 2.9885333 ] [ -5.3412093 0.6556013 -3.1975088 ] [ 0.6138362 3.5707824 0.8092386 ] [ 1.4500122 -1.8526798 -5.5627528 ] [ 5.0611069 -2.616268 5.5222225 ] [ 4.1298646 2.1518093 0.4527872 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.486949496651902e-09 -2.08118034357296e-09 -1.622235725240017e-09 ] [ -4.987699229242818e-09 -9.777678646613596e-10 4.788158223190911e-09 ] [ -8.557560737763495e-09 1.050389084080024e-09 -5.122973886369379e-09 ] [ 9.834740167433507e-10 5.721024126378441e-09 1.296543176250872e-09 ] [ 2.323175665854934e-09 -2.968320285843793e-09 -8.912512556878074e-09 ] [ 8.108787217356173e-09 -4.191723457881911e-09 8.847575857249064e-09 ] [ 6.616772563703756e-09 3.447578581283896e-09 7.254450720142847e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.241498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.243045513275773e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9380047 1.2033025 2.8894443 ] [ 1.8585097 2.4313005 4.9783615 ] [ 2.3175115 3.5224347 2.0600578 ] [ 3.0833358 4.3978625 4.2640061 ] [ 3.9716996 1.7204912 1.5547329 ] [ 4.0907574 2.0331145 4.0437702 ] [ 4.7502342 3.8919361 2.4890843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9380047e-10 1.2033025e-10 2.8894443e-10 ] [ 1.8585097e-10 2.4313005e-10 4.9783615e-10 ] [ 2.3175115e-10 3.5224347e-10 2.0600578e-10 ] [ 3.0833358e-10 4.3978625e-10 4.2640061e-10 ] [ 3.9716996e-10 1.7204912e-10 1.5547329e-10 ] [ 4.0907574e-10 2.0331145e-10 4.0437702e-10 ] [ 4.7502342e-10 3.8919361e-10 2.4890843e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-07 1.85e-05 9.4e-06 ] [ 1.45e-05 -9e-07 -1.27e-05 ] [ 1.14e-05 -1.88e-05 2.93e-05 ] [ 2.23e-05 -3.24e-05 1.95e-05 ] [ 3.62e-05 -2.23e-05 -2.48e-05 ] [ -8.25e-05 1.4e-05 2.58e-05 ] [ -2.7e-06 4.2e-05 -4.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2817413072e-15 2.9640267729e-14 1.50604603596e-14 ] [ 2.3231561193e-14 -1.4419589706e-15 -2.03476432518e-14 ] [ 1.82648136276e-14 -3.012092071919999e-14 4.69437753762e-14 ] [ 3.572853893819999e-14 -5.19105229416e-14 3.1242444363e-14 ] [ 5.799879415079998e-14 -3.572853893819999e-14 -3.97339805232e-14 ] [ -1.32179572305e-13 2.243047287599999e-14 4.133615715719999e-14 ] [ -4.3258769118e-15 6.729141862799998e-14 -7.450121348099999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.385491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.586551062081729e-18 } }