Pradeep R. Varadwaj - Publications, H-index & Citations

Pradeep R. Varadwaj

nicolaus copernicus university in torun

31H指数

110论文数

2.3K被引数

收录论文 37

发表时间

Negative σ-Holes on Fluorine in Molecules Revisited: Halogen Bonding or Counterintuitive, Anti-Electrostatic Interactions?氟原子上的负σ-空穴再探：卤键还是反直觉、反静电相互作用？

International Journal of Molecular Sciences

IF4.9

2026-07-23

OAAI

Pradeep R. Varadwaj; Helder M. Marques; Ireneusz Grabowski; Mohd. Mudassir Husain

Halogen Bonds or Not? Reassessing Noncovalent Interactions in Crystals of Periodate Anion from the Cambridge Structural Database 卤素键还是其他？重新评估剑桥结构数据库中高碘酸根离子晶体的非共价相互作用

Molecules

IF4.6

2026-06-18

OAAI

Arpita Varadwaj; Pradeep R. Varadwaj; Helder M. Marques; Ireneusz Grabowski; Koichi Yamashita; Mohd. Mudassir Husain

Anti-Electrostatic Anion-Anion Noncovalent Interactions Are Not Halogen Bonds: Evidence from X···O Contacts in XO4− Dimers and Oligomers in Crystals Structures 抗静电阴离子-阴离子非共价相互作用不是卤素键: 来自晶体结构中XO4-二聚体和低聚物中X·O接触的证据

International Journal of Molecular Sciences

IF4.9

2026-06-10

OAAI

Arpita Varadwaj; Pradeep R. Varadwaj; Helder M. Marques; Bogumiła Jezierska; Ireneusz Grabowski; Mohd. Mudassir Husain; Koichi Yamashita

Molecular Electrostatic Surface Potential: A Predictive Framework for Noncovalent Interactions and Adsorption Characteristics in Molecular Entities 分子静电势表面：预测分子实体中非共价相互作用和吸附特性的框架

International Journal of Molecular Sciences

IF4.9

2026-04-08

OAAI

Pradeep R. Varadwaj; Helder M. Marques; Arpita Varadwaj; Ireneusz Grabowski; Koichi Yamashita

Oxidation and Chlorination Reaction Characteristics: A Density Functional Theory Perspective toward the Fundamental Understanding of Etching of Ruthenium and Tantalum Surfaces 氧化与氯化反应特性：基于密度泛函理论对钌和钽表面蚀刻机理的基本理解

ACS Omega

IF4.3

2026-03-01

OAAI

Pradeep R. Varadwaj; Yutaka Imamura; Ryoji Asahi

Halogen Bonds Formed by Halogen's p/π-Hole in Molecules Help Shape Crystalline Materials 由分子中卤素的p/π-空穴形成的卤键有助于塑造晶体材料

CRYSTAL GROWTH & DESIGN

IF3.4

2025-04-24

PREAI

Varadwaj, Pradeep R.; Marques, Helder M.; Grabowski, Ireneusz

Realization of Ideal Ba Promoter State by Simultaneous Incorporation with Co into Carbon-protective Framework for Ammonia Synthesis Catalyst

ADVANCED ENERGY MATERIALS

IF26

2024-12-10

OAAI

De Silva, K. Kanishka H.; Sato, Katsutoshi; Naito, Takahiro; Toriyama, Takaaki; Yamamoto, Tomokazu; Aso, Ryotaro; Murakami, Yasukazu; Varadwaj, Pradeep R.; Asahi, Ryoji; Inazu, Koji; Nagaoka, Katsutoshi

π-Hole Halogen Bonds Are Sister Interactions to σ-Hole Halogen Bonds

CRYSTAL GROWTH & DESIGN

IF3.4

2024-09-09

PREAI

Varadwaj, Pradeep R.; Marques, Helder M.; Varadwaj, Arpita; Yamashita, Koichi

Definition of the Halogen Bond (IUPAC Recommendations 2013): A Revisit

CRYSTAL GROWTH & DESIGN

IF3.4

2024-06-24

PREAI

Varadwaj, Pradeep R.; Varadwaj, Arpita; Marques, Helder M.; Yamashita, Koichi

Polymorphs of Titanium Dioxide: An Assessment of the Variants of Projector Augmented Wave Potential of Titanium on Their Geometric and Dielectric Properties 二氧化钛的多晶型物: 对钛的投影仪增强波势的变体的几何和介电特性的评估

ACS OMEGA

IF4.3

2023-06-07

OAAI

Varadwaj, Pradeep R.; Dinh, Van An; Morikawa, Yoshitada; Asahi, Ryoji

Tetrel Bonding in Anion Recognition: A First Principles Investigation 阴离子识别中的Tetrel键: 第一性原理研究

MOLECULES

IF4.6

2022-12-02

OAAI

Varadwaj, Pradeep R.

Definition of the Pnictogen Bond: A Perspective Pnictogen债券的定义: 一个视角

INORGANICS

IF3

2022-09-21

OAAI

Varadwaj, Arpita; Varadwaj, Pradeep R.; Marques, Helder M.; Yamashita, Koichi

The Pnictogen Bond: The Covalently Bound Arsenic Atom in Molecular Entities in Crystals as a Pnictogen Bond Donor Pnicogen键: 晶体中分子实体中共价结合的砷原子作为pnicogen键供体

MOLECULES

IF4.6

2022-05-25

OAAI

Varadwaj, Arpita; Varadwaj, Pradeep R.; Marques, Helder M.; Yamashita, Koichi

The Phosphorus Bond, or the Phosphorus-Centered Pnictogen Bond: The Covalently Bound Phosphorus Atom in Molecular Entities and Crystals as a Pnictogen Bond Donor 磷键或以磷为中心的pnicogen键: 分子实体和晶体中共价结合的磷原子作为pnicogen键供体

MOLECULES

IF4.6

2022-02-23

OAAI

Varadwaj, Pradeep R.; Varadwaj, Arpita; Marques, Helder M.; Yamashita, Koichi

Chalcogen•••Chalcogen Bonding in Molybdenum Disulfide, Molybdenum Diselenide and Molybdenum Ditelluride Dimers as Prototypes for a Basic Understanding of the Local Interfacial Chemical Bonding Environment in 2D Layered Transition Metal Dichalcogenides

INORGANICS

IF3

2022-01-12

OAAI

Varadwaj, Pradeep R.; Marques, Helder M.; Varadwaj, Arpita; Yamashita, Koichi

The Cs2AgRhCl6 Halide Double Perovskite: A Dynamically Stable Lead-Free Transition-Metal Driven Semiconducting Material for Optoelectronics

FRONTIERS IN CHEMISTRY

IF4.2

2020-10-28

OAAI

Varadwaj, Pradeep R.; Marques, Helder M.

A2AgCrBr6 (A = K, Rb, Cs) and Cs2AgCrX6(X = Cl, I) Double Perovskites: A Transition-Metal-Based Semiconducting Material Series with Remarkable Optics

NANOMATERIALS

IF4.3

2020-05-18

OAAI

Varadwaj, Pradeep R.

Soft X-ray Absorption Spectroscopy Probes OH•••π Interactions in Epoxy-Based Polymers

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2020-04-10

PREAI

Yamane, Hiroyuki; Oura, Masaki; Takahashi, Osamu; Fons, Paul; Varadwaj, Pradeep R.; Shimoi, Yukihiro; Ohkubo, Masataka; Ishikawa, Tetsuya; Yamazaki, Noriko; Hasegawa, Koichi; Takagi, Kiyoka; Hatsui, Takaki

Physical and optoelectronic features of lead-free A2AgRhBr6(A = Cs, Rb, K, Na, Li) with halide double perovskite composition

JOURNAL OF MATERIALS CHEMISTRY C

IF5.1

2020-01-01

PREAI

Varadwaj, Pradeep R.; Marques, Helder M.

Does Oxygen Feature Chalcogen Bonding?

MOLECULES

IF4.6

2019-08-30

OAAI

Varadwaj, Pradeep R.

研究方向