Quantum Chemistry with Quantum Computers and Neural Networks
- Antonio Mezzacapo
- Bryce Fuller
- et al.
- 2021
- ACS Spring 2021
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15 results at ACS Spring 2021
Transformer-based neural networks capture organic chemistry grammar from unsupervised learning of chemical reactions
- Philippe Schwaller
- Benjamin Hoover
- et al.
- 2021
- ACS Spring 2021
Towards the use of quantum computers for chemistry simulations
- 2021
- ACS Spring 2021
Experimental challenges for molecular simulation on noisy quantum computers
- Abhinav Kandala
- 2021
- ACS Spring 2021
Hardware efficient quantum algorithms for vibrational structure calculations
- Pauline Jeanne Ollitrault
- Alberto Baiardi
- et al.
- 2021
- ACS Spring 2021