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All papers authored by Anu Bala

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2023 Anu Bala

ORCID

, Vijay Kumar

Fluorinated 2-Phenylethylammonium Spacer Cations for Improved Stability of Ruddlesden–Popper Pb/Sn Halide Perovskites: Insight from First-Principles Calculations

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Anu Bala

ORCID

ORCID

Enhanced stability of triple-halide perovskites CsPbI_3−x−yBr_xCl_y (x and y = 0–0.024): understanding the role of Cl doping from ab initio calculations

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2021 Anu Bala

ORCID

ORCID

Direct band gap halide-double-perovskite absorbers for solar cells and light emitting diodes: Ab initio study of bulk and layers

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Anu Bala

ORCID

, Vijay Kumar

Effects of Cl and F Substitution in Phenylethylammonium Spacer Cations on Stability, Structure, and Optical Properties of 2D–3D Ruddlesden–Popper Perovskite Layers

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2020 Anu Bala

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ORCID

A Study of Eu Doping in Nanolayers of CsPbBr3 using Ab Initio Calculations to Understand f–f Transitions in Eu3+-Doped Nanocrystals for Light-Emitting Diodes

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Lidia Romani, Anu Bala

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ORCID

, Andrea Speltini, Antonella Milella, Francesco Fracassi, Andrea Listorti

ORCID

, Antonella Profumo, Lorenzo Malavasi

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PEA2SnBr4: a water-stable lead-free two-dimensional perovskite and demonstration of its use as a co-catalyst in hydrogen photogeneration and organic-dye degradation

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2019 Anu Bala

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, Vijay Kumar

Role of Ligand–Ligand Interactions in the Stabilization of Thin Layers of Tin Bromide Perovskite: An Ab Initio Study of the Atomic and Electronic Structure, and Optical Properties

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Anu Bala

ORCID

, Vijay Kumar

Stability of the Eu2+ Dopant in CsPbBr3 Perovskites: A First-Principles Study

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Sanjay Dutta, Vikas Vikas, Ashok Yadav, Ramamoorthy Boomishankar

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, Anu Bala

ORCID

ORCID

, Tirthankar Chakraborty, Suja Elizabeth

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, Parthapratim Munshi

ORCID

Record-high thermal stability achieved in a novel single-component all-organic ferroelectric crystal exhibiting polymorphism

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2018 Anu Bala

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, Arpan Krishna Deb, Vijay Kumar

Atomic and Electronic Structure of Two-Dimensional Inorganic Halide Perovskites An+1MnX3n+1 (n = 1–6, A = Cs, M = Pb and Sn, and X = Cl, Br, and I) from ab Initio Calculations

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2013 Poorva Singh, Anu Bala

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, Tashi Nautiyal, Sushil Auluck

An insight into evolution of electronic, magnetic, optical, and vibrational properties of ultrathin Pd nanowires

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Anu Bala

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, Poorva Singh, Tashi Nautiyal, Sushil Auluck

Magnetic CrX and MnX (X=Si, Ge, and As) nanowires: Stability enhancement and linearization

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2010 Anu Bala

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, Poorva Singh, Tashi Nautiyal, Sushil Auluck

Theoretical studies on electronic and magnetic properties of ultrathin Mo nanowires

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2009 Anu Bala

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, Tashi Nautiyal, Sushil Auluck

Electronic and magnetic behavior of ultrathin Ti nanowires

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2008 Anu Bala

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, Tashi Nautiyal

Electronic and magnetic properties of basic nanosystems of early 3d transition metals (Sc, Ti, V, Cr, and Mn)

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Anu Bala

ORCID

, Tashi Nautiyal, Sushil Auluck

Basic nanosystems of early 4d and 5d transition metals: Electronic properties and the effect of spin-orbit interaction

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2006 Anu Bala

ORCID

, Tashi Nautiyal, Kwang S. Kim

Effect of dimensionality on transition-metal elements of groups 3–7

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