Hi all,
Martha will present at the group meeting tomorrow. Her title and abstract can be found below. We will meet in SS571 at 2:30pm. If you would like to connect to the meeting via Skype, please send me your information.
Best,
Riley
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Title: Exploration of 2,2’-bipyridines as electroactive compounds in flow batteries
Abstract: I will talk about compounds from the 2,2’-bipyridine family that were investigated to be used as electro-active materials in flow batteries. Calculations on redox potential, pKa and solubility were performed on a small subset of derivatives finding some promising molecules for potential application as negative redox-active electrolytes. Also, in combination with ML approaches such as Phoenics/Gryffin that allows the exploration of the molecular space in an efficient way, the search can be guided towards the discovery of new electrolytes.
Hi all,
Jakob will present at group meeting tomorrow. Abstract can be found below. We will meet in SS571 at 2:30pm. If you would like to join the meeting via Skype, please let me know.
Best,
Riley
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Abstract: I'm going to give a gentle introduction about the compression of quantum states with emphasis on encoded chemical systems into qubits and some potential applications and strategies associated with it.
Hi all,
Ian will speak at the group meeting tomorrow. His title and abstract can be found below. We will meet in SS571 at 2:30pm. Please be on time. If you'd like to connect via Skype, let me know.
Best,
Riley
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Title: Phase estimation with randomized Hamiltonians
Abstract: Phase estimation is commonly used in quantum simulation to estimate Hamiltonian eigenenergies. However, not all terms in the Hamiltonian contribute equally to the energy. Motivated by this, I will discuss theoretical and numerical work allowing us to reduce the cost of phase estimation by changing how frequently different Hamiltonian terms are simulated. The same approach also allows us to better understand the errors in different simulation approaches.
