Configuration Set

QM_Hamiltonian_ethanol_dft__CS_b9rdnql4q2ap_0




Name QM_Hamiltonian_ethanol_dft
Extended ID QM_Hamiltonian_ethanol_dft__CS_b9rdnql4q2ap_0
Description All ethanol dft configurations from the Quantum Machine Molecular Hamiltonians and Overlap Matrices set
Elements C (22.22%)
H (66.67%)
O (11.11%)
Number of Configurations 30,000
Number of Atoms 270,000
Configurations