Shajan, Akhil

1. Accurate quantum-centric simulations of supramolecular interactions
   2024/10/11 by Kaliakin, Danil, Shajan, Akhil, Moreno, Javier Robledo +9 · 9 citations
   #FOS: Physical sciences #Quantum Physics (quant-ph)
2. Implicit solvent sample-based quantum diagonalization
   2025/02/14 by Danil Kaliakin, Kaliakin, Danil, Akhil Shajan +5 · 9 citations
   Chemistry · Physics and Astronomy · #FOS: Physical sciences #Molecular spectroscopy and chirality #Quantum Physics (quant-ph) #Spectroscopy and Quantum Chemical Studies
3. Towards quantum-centric simulations of extended molecules: sample-based quantum diagonalization enhanced with density matrix embedding theory
   2024/11/15 by Akhil Shajan, Danil Kaliakin, Shajan, Akhil +21 · 2 citations
   Physics and Astronomy · #Advanced Chemical Physics Studies #FOS: Physical sciences #Quantum Physics (quant-ph) #Quantum and electron transport phenomena #Spectroscopy and Quantum Chemical Studies
4. Molecular Quantum Computations on a Protein
   2025/12/18 by Akhil Shajan, Shajan, Akhil, Danil Kaliakin +17 · 2 citations
   Physics and Astronomy · Biochemistry, Genetics and Molecular Biology · Computer Science · #Advanced Chemical Physics Studies #Protein Structure and Dynamics #Quantum Computing Algorithms and Architecture