Andrea Zen

20PUBLICATIONS
51CO-AUTHORS
HydrometallurgyComputational complexity and computabilityCondensed matter modelling and density functional theoryTheoretical quantum chemistryStatistical mechanics in chemistry
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Publications (20)

|Aug 05, 2026
Toward viable H2 storage in Ca decorated low-dimensional materials with insights from reference quantum Monte Carlo.

|Sep 08, 2025
Reproducibility of fixed-node diffusion Monte Carlo across diverse community codes: The case of water-methane dimer.

Flaviano Della Pia, Benjamin X Shi, Yasmine S Al-Hamdani

|Aug 19, 2025
Interaction strength of carbon dioxide on graphene from periodic quantum diffusion Monte Carlo.

Flaviano Della Pia, Giaan Kler-Young, Andrea Zen

|Aug 13, 2025
An accurate and efficient framework for modelling the surface chemistry of ionic materials.

Benjamin X Shi, Andrew S Rosen, Tobias Schäfer

|May 26, 2025
Accurate and efficient machine learning interatomic potentials for finite temperature modelling of molecular crystals.

Flaviano Della Pia, Benjamin X Shi, Venkat Kapil

|Apr 30, 2025
Basis Set Incompleteness Errors in Fixed-Node Diffusion Monte Carlo Calculations on Noncovalent Interactions.

Kousuke Nakano, Benjamin X Shi, Dario Alfè

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Frequent Collaborators

12 joint publications

Angelos Michaelides

12 joint publications

Dario Alfè

6 joint publications

Flaviano Della Pia

6 joint publications

Benjamin X Shi