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h5 指数:34
h5 中位数:45

h5 指数是指在过去整整 5 年中所发表文章的 h 指数。h 指在 2018-2022 年间发表的 h 篇文章每篇至少都被引用过 h 次的最大值。隐藏

出版物的 h5 中位数，是指出版物的 h5 指数所涵盖的所有文章获得的引用次数的中位值。隐藏

#16 Spectroscopy & Molecular Physics

标题/作者	引用次数	年份
Shermo: A general code for calculating molecular thermochemistry properties T Lu, Q Chen Computational and Theoretical Chemistry 1200, 113249	220	2021
Designing N-phenylaniline-triazol configured donor materials with promising optoelectronic properties for high-efficiency solar cells MY Mehboob, R Hussain, MU Khan, M Adnan, A Umar, MU Alvi, ... Computational and Theoretical Chemistry 1186, 112908	97	2020
Designing of benzothiazole based non-fullerene acceptor (NFA) molecules for highly efficient organic solar cells RA Shehzad, J Iqbal, MU Khan, R Hussain, HMA Javed, A ur Rehman, ... Computational and Theoretical Chemistry 1181, 112833	82	2020
Highly selective acridinium based cyanine dyes for the detection of DNA base pairs (adenine, cytosine, guanine and thymine) H Sajid, K Ayub, M Arshad, T Mahmood Computational and Theoretical Chemistry 1163, 112509	73	2019
Chitosan/graphene oxide composite as an effective removal of Ni, Cu, As, Cd and Pb from wastewater AA Menazea, HA Ezzat, W Omara, OH Basyouni, SA Ibrahim, ... Computational and Theoretical Chemistry 1189, 112980	68	2020
Online conferences–Towards a new (virtual) reality G Roos, J Oláh, R Ingle, R Kobayashi, M Feldt Computational and Theoretical Chemistry 1189, 112975	66	2020
Efficient tuning of triphenylamine-based donor materials for high-efficiency organic solar cells SA Siddique, MBA Siddique, R Hussain, X Liu, MY Mehboob, Z Irshad, ... Computational and Theoretical Chemistry 1191, 113045	65	2020
Effect of fluorination on exciton binding energy and electronic coupling in small molecule acceptors for organic solar cells A Mahmood, A Irfan Computational and Theoretical Chemistry 1179, 112797	64	2020
Density functional studies on the binding of methanol and ethanol molecules to graphyne nanosheet V Nagarajan, S Dharani, R Chandiramouli Computational and Theoretical Chemistry 1125, 86-94	55	2018
Development of fullerene free acceptors molecules for organic solar cells: A step way forward toward efficient organic solar cells M Ans, K Ayub, S Muhammad, J Iqbal Computational and Theoretical Chemistry 1161, 26-38	53	2019
First-principles study of the adsorption of chlormethine anticancer drug on C24, B12N12 and B12C6N6 nanocages MR Hossain, MM Hasan, SUD Shamim, T Ferdous, MA Hossain, F Ahmed Computational and Theoretical Chemistry 1197, 113156	53	2021
Quantum chemical analysis and molecular dynamics simulations to study the impact of electron-deficient substituents on electronic behavior of small molecule acceptors A Mahmood, A Irfan, F Ahmad, MRSA Janjua Computational and Theoretical Chemistry 1204, 113387	51	2021
Computational study of the chemical reactivity of the Blue-M1 intermediate melanoidin J Frau, D Glossman-Mitnik Computational and Theoretical Chemistry 1134, 22-29	51	2018
Theoretical study of N-thiazolyl-2-cyanoacetamide derivatives as corrosion inhibitor for aluminum in alkaline environments XY Zhang, QX Kang, Y Wang Computational and Theoretical Chemistry 1131, 25-32	48	2018
Doping of the first row transition metals onto B12N12 nanocage: A DFT study M Abbasi, E Nemati-Kande, MD Mohammadi Computational and Theoretical Chemistry 1132, 1-11	47	2018
The adsorption of bromomethane onto the exterior surface of aluminum nitride, boron nitride, carbon, and silicon carbide nanotubes: A PBC-DFT, NBO, and QTAIM study MD Mohammadi, M Hamzehloo Computational and Theoretical Chemistry 1144, 26-37	45	2018
Ground state geometries, UV/vis absorption spectra and charge transfer properties of triphenylamine-thiophenes based dyes for DSSCs: A TD-DFT benchmark study ZME Fahim, SM Bouzzine, AA Youssef, M Bouachrine, M Hamidi Computational and Theoretical Chemistry 1125, 39-48	45	2018
Designing of benzodithiophene acridine based Donor materials with favorable photovoltaic parameters for efficient organic solar cell Q ul Ain, RA Shehzad, U Yaqoob, A Sharif, Z Sajid, S Rafiq, S Iqbal, ... Computational and Theoretical Chemistry 1200, 113238	45	2021
Analysis of single and multi-wall carbon nanotubes (SWCNT/MWCNT) in the flow of Maxwell nanofluid with the impact of magnetic dipole V Kumar, JK Madhukesh, AM Jyothi, BC Prasannakumara, MI Khan, ... Computational and Theoretical Chemistry 1200, 113223	45	2021
First-principles insights on detection of dimethyl amine and trimethyl amine vapors using graphdiyne nanosheets V Nagarajan, U Srimathi, R Chandiramouli Computational and Theoretical Chemistry 1123, 119-127	45	2018

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