The HOMO and LUMO molecular orbitals for relaxed structures of N2O

The relaxed (Li3O)n@C24N24 structures

Tuning the HOMO–LUMO Energy Gap of Small Diamondoids Using Inverse Molecular Design

Tuning the HOMO–LUMO Energy Gap of Small Diamondoids Using Inverse Molecular Design

Cooperative small molecule activation by apolar and weakly polar bonds through the lens of a suitable computational protocol - Chemical Communications (RSC Publishing) DOI:10.1039/D3CC05614G

The HOMO and LUMO molecular orbitals for relaxed structures of N2O

Rh19−: A high-spin super-octahedron cluster

HOMO and LUMO for SO 3 , free 2PANI, 2PANI-SO 3 (1) and 2PANI-SO 3 (2)

Activation of CO and CO2 on homonuclear boron bonds of fullerene-like BN cages: first principles study

Molecular orbitals - HOMO and LUMO in easy way

Tuning the HOMO–LUMO Energy Gap of Small Diamondoids Using Inverse Molecular Design

color online). Molecular orbitals of Bz around the HOMO and LUMO

Isosurface of the HOMO and LUMO orbitals of the N2O molecule, B12N12

N2O reduction over a fullerene-like boron nitride nanocage: A DFT study - ScienceDirect