Zobrazeno 1 - 10
of 153
pro vyhledávání: '"Barnett, R. N."'
Publikováno v:
Phys. Rev. Lett. 100, 046801 (2008)
Spin-density-functional calculations of tip-suspended gold chains, with molecular oxygen, or dissociated oxygen atoms, incorporated in them, reveal structural transitions for varying lengths. The nanowires exhibit enhanced strength for both oxygen in
Externí odkaz:
http://arxiv.org/abs/1311.5723
The properties of neutral and anionic Pd_N clusters were investigated with spin-density-functional calculations. The ground state structures are three-dimensional for N>3 and they are magnetic with a spin-triplet for 2<=N<=7 and a spin nonet for N=13
Externí odkaz:
http://arxiv.org/abs/physics/0101069
Structural transformations, electronic spectra and ballistic transport in pulled gold nanowires are investigated with ab initio simulations, and correlated with recent measurements. Strain-induced yield of an initial double-strand wire results first
Externí odkaz:
http://arxiv.org/abs/cond-mat/0009154
Publikováno v:
Philosophical Transactions: Physical Sciences and Engineering, 1992 Nov . 341(1661), 337-350.
Externí odkaz:
https://www.jstor.org/stable/53940
Publikováno v:
Quantum Monte Carlo: Origins, Development, Applications.
Externí odkaz:
https://doi.org/10.1093/oso/9780195310108.003.00108
Publikováno v:
Quantum Monte Carlo: Origins, Development, Applications.
Externí odkaz:
https://doi.org/10.1093/oso/9780195310108.003.0080
Publikováno v:
Quantum Monte Carlo: Origins, Development, Applications.
Externí odkaz:
https://doi.org/10.1093/oso/9780195310108.003.0042
Publikováno v:
Journal of Chemical Physics; 5/1/1986, Vol. 84 Issue 9, p4992, 5p
Publikováno v:
Journal of Chemical Physics; 3/15/1985, Vol. 82 Issue 6, p2700, 8p
Calculation of strain and polarization fields at the surface of MgO crystals. Breathing shell model.
Autor:
Barnett, R. N., Bass, Ronald
Publikováno v:
Journal of Chemical Physics; Nov1977, Vol. 67 Issue 10, p4620-4625, 6p