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1
Material Type:
Dissertação de Mestrado
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Efeitos de matriz nas propriedades do plasma LIBS para quantificação de carbono

Franco, Marco Aurélio De Menezes

Biblioteca Digital de Teses e Dissertações da USP; Universidade de São Paulo; Instituto de Física de São Carlos 2017-06-26

Acesso online. A biblioteca também possui exemplares impressos.

2
Relativistic Coupled Cluster Calculations with Variational Quantum Electrodynamics Resolve the Discrepancy between Experiment and Theory Concerning the Electron Affinity and Ionization Potential of Gold
Material Type:
Artigo
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Relativistic Coupled Cluster Calculations with Variational Quantum Electrodynamics Resolve the Discrepancy between Experiment and Theory Concerning the Electron Affinity and Ionization Potential of Gold

Pašteka, L F ; Eliav, E ; Borschevsky, A ; Kaldor, U ; Schwerdtfeger, P

Physical review letters, 2017-01, Vol.118 (2), p.023002-023002, Article 023002 [Periódico revisado por pares]

United States

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3
Calculation of vertical and adiabatic ionization potentials for some benzaldehydes using hybrid DFT, multilevel G3B3 and MP2 methods
Material Type:
Artigo
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Calculation of vertical and adiabatic ionization potentials for some benzaldehydes using hybrid DFT, multilevel G3B3 and MP2 methods

Safi, Zaki S. ; Wazzan, Nuha ; Aqel, Halima

Chemical physics letters, 2022-03, Vol.791, p.139349, Article 139349 [Periódico revisado por pares]

Elsevier B.V

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4
Towards a pair natural orbital coupled cluster method for excited states
Material Type:
Artigo
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Towards a pair natural orbital coupled cluster method for excited states

Dutta, Achintya Kumar ; Neese, Frank ; Izsák, Róbert

The Journal of chemical physics, 2016-07, Vol.145 (3), p.034102-034102 [Periódico revisado por pares]

United States: American Institute of Physics

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5
Multi-step laser excitation of the highly excited 5snf 1F3 states of cadmium
Material Type:
Artigo
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Multi-step laser excitation of the highly excited 5snf 1F3 states of cadmium

Khan, Fatima Ali ; Shah, M. ; Haq, S.U. ; Nadeem, Ali

Spectrochimica acta. Part B: Atomic spectroscopy, 2023-01, Vol.199, p.106574, Article 106574 [Periódico revisado por pares]

Elsevier B.V

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6
Cobalt(VI)-oxo species-mediated selective oxidation of electron-rich organic contaminants by Co-loaded hydroxylated g-C3N4 with high resistance to an inhibitory effect of background constituents
Material Type:
Artigo
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Cobalt(VI)-oxo species-mediated selective oxidation of electron-rich organic contaminants by Co-loaded hydroxylated g-C3N4 with high resistance to an inhibitory effect of background constituents

Lee, Youn-Jun ; Son, Chae-Young ; Jeong, Yoo Jae ; Cho, In Sun ; Park, Seong-Jik ; Lee, Chang-Gu

Applied surface science, 2024-10, Vol.669, p.160545, Article 160545 [Periódico revisado por pares]

Elsevier B.V

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7
Efficient degradation of antibiotics by non-thermal discharge plasma: Highlight the impacts of molecular structures and degradation pathways
Material Type:
Artigo
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Efficient degradation of antibiotics by non-thermal discharge plasma: Highlight the impacts of molecular structures and degradation pathways

Li, Hu ; Li, Tengfei ; He, Sitong ; Zhou, Jian ; Wang, Tiecheng ; Zhu, Lingyan

Chemical engineering journal (Lausanne, Switzerland : 1996), 2020-09, Vol.395, p.125091, Article 125091 [Periódico revisado por pares]

Elsevier B.V

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8
Absolute energy levels of liquid water from many-body perturbation theory with effective vertex corrections
Material Type:
Artigo
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Absolute energy levels of liquid water from many-body perturbation theory with effective vertex corrections

Tal, Alexey ; Bischoff, Thomas ; Pasquarello, Alfredo

Proceedings of the National Academy of Sciences - PNAS, 2024-03, Vol.121 (10), p.e2311472121 [Periódico revisado por pares]

United States: National Academy of Sciences

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9
Substitution effect on the adiabatic ionization potential, vertical ionization potential, electrophilicity, and nucleophilicity of some hydantoin drug derivatives: Computational study
Material Type:
Artigo
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Substitution effect on the adiabatic ionization potential, vertical ionization potential, electrophilicity, and nucleophilicity of some hydantoin drug derivatives: Computational study

Safi, Zaki ; Wazzan, Nuha

Journal of physical organic chemistry, 2023-11, Vol.36 (11) [Periódico revisado por pares]

Bognor Regis: Wiley Subscription Services, Inc

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10
Ionization potential-based design of deep eutectic solvent for recycling of spent lithium ion batteries
Material Type:
Artigo
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Ionization potential-based design of deep eutectic solvent for recycling of spent lithium ion batteries

Hua, Yunhui ; Sun, Yongqi ; Yan, Feng ; Wang, Shubin ; Xu, Zhenghe ; Zhao, Baojun ; Zhang, Zuotai

Chemical engineering journal (Lausanne, Switzerland : 1996), 2022-05, Vol.436, p.133200, Article 133200 [Periódico revisado por pares]

Elsevier B.V

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