Due to their solution processability and unique photoelectric
characteristics,
perovskite solar cells (PSCs) have shown considerable promise in the
area of renewable energy. Although their power conversion efficiency
(PCE) has risen from 3.8% to 25.7% in only a few years, their short
lifetime and high material prices continue to be key roadblocks to
commercial viability. Charge transporting materials (CTMs), such as
hole/electron transporting materials, are critical components in PSCs
because they not only govern hole or electron extraction and transporting
from the perovskite layer to the electrodes but also protect the perovskite
from direct contact with the ambient environment. CTMs are split into
two types: inorganic CTMs (ICTMs) and organic CTMs (OCTMs). Because
of their inexpensive prices, well-adjusted energy levels, and low
temperature solution-processed features, OCTMs have been more frequently
explored and employed than ICTMs. Various forms of OCTMs with more
straightforward synthetic pathways and better performance have been
thoroughly researched. Recent achievements in the development of OCTMs
will be discussed and evaluated on a molecular level in this study,
which will include a systematic categorization of OCTMs based on molecular
functionalization techniques. In order to achieve highly efficient
and stable PSCs, we will present insights on the structure–property
relationship in the design of OCTMs as well as device stability. We
hope that this analysis will serve as a comprehensive reference to
molecular design guidelines for various types of OCTMs, spurring greater
research toward designing highly efficient and OCTMs for stable PSCs.