Carlo Adamo - Publications, H-index & Citations

Carlo Adamo

Chimie ParisTech

87H指数

583论文数

5.3W被引数

收录论文 197

发表时间

Uncontrolled polymerizations: lessons from accident case studies 失控聚合：事故案例研究中的经验教训

Journal of Loss Prevention in the Process Industries

IF4.2

2026-08-05

PREAI

Daniele Maccarone; Patricia Rotureau; Carlo Adamo; Guillaume Fayet

Pyrolysis-Derived Telechelic Polypropylene Enables Mechanochromic Mapping of Cavitation in Polyolefin Matrices 热解衍生的遥爪聚丙烯可以在聚烯烃基质中实现空化的机械变色映射

j. mater. chem. c

IF0

2026-05-29

PREAI

Benedetta Bertoncini; Giorgio Bancalà; Weronika Nowicka; Antonella Battisti; Irene Pusceddu; Michele Turelli; Jeevanandham Neethirajan; Giuseppe Portale; Rob Duchateau; Carlo Adamo; Andrea Pucci; Marco Carlotti

Long Versus Short Chain Covalent Functionalization in the Preparation of Mechanochromic Polymers 长链与短链共价功能化在力致变色聚合物制备中的应用

Chemistry–Methods

IF0

2026-04-20

OAAI

B. Bertoncini; S. Gabellini; C. Adamo; A. Pucci; S. Scurti; M. Carlotti

Emission Using Adaptable Range Separated Hybrids: Thermally Activated Delayed Fluorescence Emitters as Test Case 使用可调谐范围分离杂化方法：以热活化延迟荧光发射体为测试案例

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2025-12-05

OAAI

Yan, Tianhong; Adamo, Carlo; Ciofini, Ilaria

Toward a mechanistic understating of bioluminescence: a theoretical study of furimazine oxidation and luminescence 迈向对生物发光的机制理解：呋喃嗪氧化和发光的理论研究

Phys. Chem. Chem. Phys.

IF2.9

2025-11-19

PREAI

Alessandro Bonardi; Michele Turelli; Anna Ranaudo; Giorgio Moro; Claudio Greco; Ilaria Ciofini; Ugo Cosentino; Carlo Adamo

On the Stability of Perfluoroisobutyronitrile in High-Voltage Circuit Breaker: A Computational Study 高压断路器中全氟异丁腈的稳定性：一项计算研究

ACS Omega

IF4.3

2025-10-15

OAAI

Muhammad Bilal Arif; Michele Turelli; Maxime Lacuve; Christophe Coquelet; Carlo Adamo

Benchmarking Density Functional Approximations in Nonadiabatic Dynamics: Trans–Cis Isomerization in Retinal Model 非绝热动力学中密度泛函近似的基准测试：视黄醛模型的反-顺异构化

Journal of Chemical Theory and Computation

IF5.5

2025-09-30

PREAI

Lea M. Ibele; Carlo Adamo; Davide Avagliano

First-Principles Modeling of the Electronic and Optical Properties of Biogenic Crystals: The Case of Anhydrous Guanine 基于第一性原理的生物质晶体电子与光学性质建模：以无水鸟嘌呤为例

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2025-04-17

PREAI

Senou, Parfaite; Adamo, Carlo; Labat, Frederic

Adaptable Range-Separated Hybrids for the Description of Excited States: Tuning the Range Separation Parameter on Effective Charge Transfer Distance

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2025-02-12

PREAI

Yan, Tianhong; Bonardi, Alessandro; Adamo, Carlo; Ciofini, Ilaria

Improving the Reliability of, and Confidence in, DFT Functional Benchmarking through Active Learning 通过主动学习提高DFT功能基准测试的可靠性和信心

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2025-02-02

PREAI

Alfonso-Ramos, Javier E.; Adamo, Carlo; Bremond, Eric; Stuyver, Thijs

The vibrational spectra of a model boron dipyrromethene molecule in condensed phase: Experimental and theoretical insights 凝聚相中模型硼二吡咯亚甲基分子的振动光谱: 实验和理论见解

DYES AND PIGMENTS

IF4.2

2024-12-01

OAAI

Feis, Alessandro; Gellini, Cristina; Pagliai, Marco; Ricci, Marilena; Adamo, Carlo; Ciofini, Ilaria; Korsaye, Feven Alemu; Turelli, Michele

Comment on Dispersion-corrected r2SCAN based double-hybrid functionals

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2024-08-02

OAAI

Bremond, Eric; Jose Perez-Jimenez, Angel; Sancho-Garcia, Juan Carlos; Adamo, Carlo

Modeling Multi-Step Organic Reactions: Can Density Functional Theory Deliver Misleading Chemistry?多步有机反应的理论模拟：密度泛函理论会给出误导性的化学结果吗？

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2024-02-27

OAAI

Li, Hanwei; Kermani, Maryam Mansoori; Ottochian, Alistar; Crescenzi, Orlando; Janesko, Benjamin G.; Truhlar, Donald G.; Scalmani, Giovanni; Frisch, Michael J.; Ciofini, Ilaria; Adamo, Carlo

SOS1-RSX-QIDH: A spin-opposite-scaled range-separated-exchange quadratic-integrand double-hybrid density functional

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2023-12-15

PREAI

Bremond, Eric; Perez-Jimenez, Angel Jose; Sancho-Garcia, Juan Carlos; Adamo, Carlo

Assessment of the nonempirical r2SCAN-QIDH double-hybrid density functional against large and diverse datasets

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2023-10-09

OAAI

Bremond, E.; Rodriguez-Mayorga, M.; Perez-Jimenez, A. J.; Adamo, C.; Sancho-Garcia, J. C.

Concerted versus stepwise proton transfer reactions in the [2, 2'-bipyridyl]-3-3'-diol molecule: A static and dynamic ab-initio investigation

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2023-08-16

OAAI

Briccolani-Bandini, Lorenzo; Bremond, Eric; Pagliai, Marco; Cardini, Gianni; Ciofini, Ilaria; Adamo, Carlo

Excitation energies of polycylic aromatic hydrocarbons by double-hybrid functionals: Assessing the PBE0-DH and PBE-QIDH models and their range-separated versions

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2023-01-23

OAAI

Sandoval-Salinas, M. E.; Bremond, E.; Perez-Jimenez, A. J.; Adamo, C.; Sancho-Garcia, J. C.

Protocols for the in-silico screening of the perceived color of industrial dyes: Anthraquinones and indigos as study cases

DYES AND PIGMENTS

IF4.2

2023-01-01

OAAI

Tirri, Bernardino; Turelli, Michele; Boissonnat, Guillaume; Ciofini, Ilaria; Adamo, Carlo

Tackling an accurate description of molecular reactivity with double-hybrid density functionals

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-04-22

OAAI

Bremond, Eric; Li, Hanwei; Jose Perez-Jimenez, Angel; Carlos Sancho-Garcia, Juan; Adamo, Carlo

Red-emitting tetraphenylethylene derivative with aggregation-induced enhanced emission for luminescent solar concentrators: A combined experimental and density functional theory study

AGGREGATE

IF13.7

2022-03-08

OAAI

Micheletti, Cosimo; Wang, Qinfan; Ventura, Francesco; Turelli, Michele; Ciofini, Ilaria; Adamo, Carlo; Pucci, Andrea

研究方向