Tuning of diphenylamine subphthalocyanine based small molecules with efficient photovoltaic parameters for organic solar cells

Triphenylamine based donor-acceptor-donor type small molecules for organic solar cells

(2021) Sadaf Bibi et al.   Computational and Theoretical Chemistry

Novel W-Shaped Oxygen Heterocycle-Fused Fluorene-Based Non-Fullerene Acceptors: First Theoretical Framework for Designing Environment-Friendly Organic Solar Cells

(2021) Muhammad Usman Khan et al.   ENERGY & FUELS

DFT molecular modeling studies of D-π-A-π-D type cyclopentadithiophene-diketopyrrolopyrrole based small molecules donor materials for organic photovoltaic cells

(2021) Rania Zaier et al.   OPTIK

Tuning the optoelectronic properties of scaffolds by using variable central core unit and their photovoltaic applications

(2021) Mahira Rafiq et al.   CHEMICAL PHYSICS LETTERS

Tuning the optoelectronic properties of benzodithiophene based donor materials and their photovoltaic applications

(2021) Ayesha Naveed et al.   MATERIALS SCIENCE IN SEMICONDUCTOR PROCESSING

Tuning the optoelectronic properties of Benzo Thiophene (BT-CIC) based Non-Fullerene Acceptor Organic Solar Cell

(2020) Saba Sabir et al.   JOURNAL OF THEORETICAL & COMPUTATIONAL CHEMISTRY

Enhanced photoelectric and photocatalysis performances of quinacridone derivatives by forming D-π-A-A structure

(2020) Dongpeng Zhao et al.   SOLAR ENERGY

Designing 2D fused ring materials for small molecules organic solar cells

(2020) Mamona Khalid et al.   Computational and Theoretical Chemistry

Designing of benzothiazole based non-fullerene acceptor (NFA) molecules for highly efficient organic solar cells

(2020) Rao Aqil Shehzad et al.   Computational and Theoretical Chemistry

Tuning the optoelectronic properties of Subphthalocyanine (SubPc) derivatives for photovoltaic applications

(2020) Afifa Farhat et al.   OPTICAL MATERIALS

Designing benzothiadiazole based non-fullerene acceptors with high open circuit voltage and higher LUMO level to increase the efficiency of organic solar cells

(2020) Amna Khalid et al.   OPTIK

Molecular designing of four high performance pyrazine-based non-fullerene acceptor materials with naphthalene diimide-based small organic solar cells

(2019) Usman Ali et al.   JOURNAL OF MOLECULAR MODELING

Benzotriazole-Based Acceptor and Donors, Coupled with Chlorination, Achieve a High VOC of 1.24 V and an Efficiency of 10.5% in Fullerene-Free Organic Solar Cells

(2019) Ailing Tang et al.   CHEMISTRY OF MATERIALS

Designing of non-fullerene 3D star-shaped acceptors for organic solar cells

(2019) Muhammad Ans et al.   JOURNAL OF MOLECULAR MODELING

Spirobifluorene based small molecules as an alternative to traditional fullerene acceptors for organic solar cells

(2019) Muhammad Ans et al.   MATERIALS SCIENCE IN SEMICONDUCTOR PROCESSING

Designing dithienothiophene (DTT)-based donor materials with efficient photovoltaic parameters for organic solar cells

(2019) Muhammad Ans et al.   JOURNAL OF MOLECULAR MODELING

Molecular designing of naphthalene diimide based fullerene-free small organic solar cell - Acceptors with high photovoltaic performance by density functional theory

(2019) Usman Ali et al.   SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

Nonfullerene Acceptor Molecules for Bulk Heterojunction Organic Solar Cells

(2018) Guangye Zhang et al.   CHEMICAL REVIEWS

Energy-crises in well-aerated and anoxic tissue: does tolerance require the same specific proteins and energy-efficient transport?

(2018) Hank Greenway et al.   FUNCTIONAL PLANT BIOLOGY

Mathematical modeling and experimental study of mechanical properties of chitosan based polyurethanes: Effect of diisocyanate nature by mixture design approach

(2018) Muhammad Asif Javaid et al.   INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES

Isatin-derived non-fullerene acceptors towards high open circuit voltage solar cells

(2018) Dong Zhao et al.   DYES AND PIGMENTS

Small-Molecule Acceptor Based on the Heptacyclic Benzodi(cyclopentadithiophene) Unit for Highly Efficient Nonfullerene Organic Solar Cells

(2017) Bin Kan et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Impact of interfacial molecular orientation on radiative recombination and charge generation efficiency

(2017) Niva A. Ran et al.   Nature Communications

Design of Cyanovinylene-Containing Polymer Acceptors with Large Dipole Moment Change for Efficient Charge Generation in High-Performance All-Polymer Solar Cells

(2017) Han-Hee Cho et al.   Advanced Energy Materials

Recent progress in non-fullerene small molecule acceptors in organic solar cells (OSCs)

(2017) Wangqiao Chen et al.   Journal of Materials Chemistry C

Correlation between Electronic Defect States Distribution and Device Performance of Perovskite Solar Cells

(2017) Giovanni Landi et al.   Advanced Science

Open circuit voltage of organic solar cells: an in-depth review

(2016) Naveen Kumar Elumalai et al.   Energy & Environmental Science

The Effect of Donor Group Rigidification on the Electronic and Optical Properties of Arylamine-Based Metal-Free Dyes for Dye-Sensitized Solar Cells: A Computational Study

(2016) Liezel L. Estrella et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Donor–π–donor type hole transporting materials: marked π-bridge effects on optoelectronic properties, solid-state structure, and perovskite solar cell efficiency

(2016) S. Paek et al.   Chemical Science

Redetermination of the crystal structure of boron subphthalocyanine chloride (Cl-BsubPc) enabled by slow train sublimation

(2016) Jessica D. Virdo et al.   Acta Crystallographica Section C-Structural Chemistry

Fe(II)-Polypyridines as Chromophores in Dye-Sensitized Solar Cells: A Computational Perspective

(2015) Elena Jakubikova et al.   ACCOUNTS OF CHEMICAL RESEARCH

Recent progress in renewable energy – Remedy of energy crisis in Pakistan

(2014) Ahmad Bilal Awan et al.   RENEWABLE & SUSTAINABLE ENERGY REVIEWS

External Electric Field-Dependent Photoinduced Charge Transfer in a Donor–Acceptor System for an Organic Solar Cell

(2013) Peng Song et al.   Journal of Physical Chemistry C

Regeneration and recombination kinetics in cobalt polypyridine based dye-sensitized solar cells, explained using Marcus theory

(2013) Sandra M. Feldt et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

The accuracy of DFT-optimized geometries of functional transition metal compounds: a validation study of catalysts for olefin metathesis and other reactions in the homogeneous phase

(2012) Yury Minenkov et al.   DALTON TRANSACTIONS

A Density Functional with Spherical Atom Dispersion Terms

(2012) Amy Austin et al.   Journal of Chemical Theory and Computation

Role of trace impurities in the photovoltaic performance of solution processed small-molecule bulk heterojunction solar cells

(2012) Wei Lin Leong et al.   Chemical Science

Energy and sustainable development in Nigeria: the way forward

(2012) Sunday Olayinka Oyedepo   Energy Sustainability and Society

Photoluminescence and magnetic circular dichroism of IrQ(ppy)2-5Cl

(2011) S. Polosan et al.   JOURNAL OF LUMINESCENCE

Extending the reliability and applicability of B3LYP

(2010) Igor Ying Zhang et al.   CHEMICAL COMMUNICATIONS

Small Molecule Solution-Processed Bulk Heterojunction Solar Cells†

(2010) Bright Walker et al.   CHEMISTRY OF MATERIALS

π-Conjugated Polymers for Organic Electronics and Photovoltaic Cell Applications†

(2010) Antonio Facchetti   CHEMISTRY OF MATERIALS

Design Rules for Donors in Bulk-Heterojunction Tandem Solar Cells?Towards 15 % Energy-Conversion Efficiency

(2008) G. Dennler et al.   ADVANCED MATERIALS

Performance of B3LYP Density Functional Methods for a Large Set of Organic Molecules

(2008) Julian Tirado-Rives et al.   Journal of Chemical Theory and Computation

B3LYP augmented with an empirical dispersion term (B3LYP-D*) as applied to molecular crystals

(2007) Bartolomeo Civalleri et al.   CRYSTENGCOMM