Shuchun Wang Kim, G., Wang, S. C., Lu, W. C., Nardelli, M. B., & Bernholc, J. (2008). Effects of end group functionalization and level alignment on electron transport in molecular devices. Journal of Chemical Physics, 128(2). Hodak, M., Wang, S., Lu, W., & Bernholc, J. (2007). Implementation of ultrasoft pseudopotentials in large-scale grid-based electronic structure calculations. PHYSICAL REVIEW B, 76(8). https://doi.org/10.1103/physrevb.76.085108 Wang, S., Lu, W., Zhao, Q., & Bernholc, J. (2006). Resonant coupling and negative differential resistance in metal/ferrocenyl alkanethiolate/STM structures. PHYSICAL REVIEW B, 74(19). https://doi.org/10.1103/physrevb.74.195430 Schmidt, W. G., Seino, K., Hahn, P. H., Bechstedt, E., Lu, W., Wang, S., & Bernholc, J. (2004, May 1). Calculation of surface optical properties: from qualitative understanding to quantitative predictions. THIN SOLID FILMS, Vol. 455, pp. 764-+. https://doi.org/10.1016/j.tsf.2003.11.263 Fleischer, K., Chandola, S., Esser, N., Richter, W., McGilp, J. F., Schmidt, W. G., … Bernholc, J. (2004, July 31). Determination of the electron inelastic mean free path in some binary alloys for application in quantitative surface analysis. APPLIED SURFACE SCIENCE, Vol. 235, pp. 15–20. https://doi.org/10.1016/j.apsusc.2004.05.117 Schmidt, W. G., Fuchs, F., Hermann, A., Seino, K., Bechstedt, F., Passmann, R., … Bernholc, J. (2004). Oxidation- and organic-molecule-induced changes of the Si surface optical anisotropy: ab initio predictions. JOURNAL OF PHYSICS-CONDENSED MATTER, 16(39), S4323–S4334. https://doi.org/10.1088/0953-8984/16/39/007 Wang, S. C., Lu, W. C., Schmidt, W. G., & Bernholc, J. (2003). Nanowire-induced optical anisotropy of the Si(111)-In surface. PHYSICAL REVIEW B, 68(3). https://doi.org/10.1103/physrevb.68.035329