216 citations · 421 across the 4 of their papers we have counts for
4 papers
Machine Learning Diffusion Monte Carlo Forces
Cancan Huang, Brenda M. Rubenstein
Diffusion Monte Carlo (DMC) is one of the most accurate techniques available for calculating the electronic properties of molecules and materials, yet it often remains a challenge…
A quantum circuit rule for interference effects in single-molecule electrical junctions
David Zsolt Manrique, Cancan Huang, Masoud Baghernejad +9
A quantum circuit rule for combining quantum interference (QI) effects in the conductive properties of oligo(phenyleneethynylene) (OPE)-type molecules possessing three aromatic rin…
Searching the hearts of graphene-like molecules for simplicity, sensitivity and logic
Sara Sangtarash, Cancan Huang, Hatef Sadeghi +7
If quantum interference patterns in the hearts of polycyclic aromatic hydrocarbons (PAHs) could be isolated and manipulated, then a significant step towards realizing the potential…
Magic ratios for connectivity-driven electrical conductance of graphene-like molecules
Yan Geng, Sara Sangtarash, Cancan Huang +7
Experiments using a mechanically-controlled break junction and calculations based on density functional theory demonstrate a new magic ratio rule (MRR),which captures the contribut…