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Material Type: Artigo
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Integrating systems analysis and control for implementing process analytical technology in bioprocess developmentGomes, James ; Chopda, Viki R. ; Rathore, Anurag S.Journal of chemical technology and biotechnology (1986), 2015-04, Vol.90 (4), p.583-589 [Periódico revisado por pares]Chichester, UK: John Wiley & Sons, LtdTexto completo disponível |
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Material Type: Artigo
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Systems chemical analytics: introduction to the challenges of chemical complexity analysisSchmitt-Kopplin, Philippe ; Hemmler, Daniel ; Moritz, Franco ; Gougeon, Régis D ; Lucio, Marianna ; Meringer, Markus ; Müller, Constanze ; Harir, Mourad ; Hertkorn, NorbertFaraday discussions, 2019-08, Vol.218, p.9-28 [Periódico revisado por pares]England: Royal Society of ChemistryTexto completo disponível |
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Material Type: Artigo
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Strong anharmonicity in the phonon spectra of PbTe and SnTe from first principlesRibeiro, Guilherme A. S. ; Paulatto, Lorenzo ; Bianco, Raffaello ; Errea, Ion ; Mauri, Francesco ; Calandra, MatteoPhysical review. B, 2018-01, Vol.97 (1), Article 014306 [Periódico revisado por pares]College Park: American Physical SocietyTexto completo disponível |
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Material Type: Artigo
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Gross vs. net energy: Towards a rational framework for assessing the practical viability of pressure retarded osmosisWang, Zhangxin ; Hou, Deyin ; Lin, ShihongJournal of membrane science, 2016-04, Vol.503, p.132-147 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |
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Material Type: Artigo
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Activation of small molecules by cyclic alkyl amino silylenes (CAASis) and germylenes (CAAGes): a theoretical studyGhosh, Bijoy ; Bharadwaz, Priyam ; Sarkar, Nibedita ; Phukan, Ashwini KDalton transactions : an international journal of inorganic chemistry, 2020-10, Vol.49 (39), p.1376-13772 [Periódico revisado por pares]Cambridge: Royal Society of ChemistryTexto completo disponível |
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Material Type: Artigo
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Refining DIIS algorithms for Si and GaAs solar cells: incorporation of weight regularization, conjugate gradient, and reverse automatic differentiation techniquesZhang, Zhaosheng ; Liu, Sijia ; Zhang, YingjiePhysical chemistry chemical physics : PCCP, 2024-04, Vol.26 (16), p.12717-12724 [Periódico revisado por pares]England: Royal Society of ChemistryTexto completo disponível |
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Material Type: Artigo
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Tailoring the composition of hydrogel particles for the controlled delivery of phytopharmaceuticalsTsirigotis-Maniecka, Marta ; Szyk-Warszyńska, Lilianna ; Maniecki, Łukasz ; Szczęsna, Weronika ; Warszyński, Piotr ; Wilk, Kazimiera A.European polymer journal, 2021-05, Vol.151, p.110429, Article 110429 [Periódico revisado por pares]Oxford: Elsevier LtdTexto completo disponível |
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Material Type: Artigo
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Efficient Calculation of Molecular Integrals over London Atomic OrbitalsIrons, Tom J. P ; Zemen, Jan ; Teale, Andrew MJournal of chemical theory and computation, 2017-08, Vol.13 (8), p.3636-3649 [Periódico revisado por pares]United States: American Chemical SocietyTexto completo disponível |
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Material Type: Artigo
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Equivalent analytical formulation-based multibody elastic system analysis using one-dimensional finite elementsVlase, Sorin ; Marin, Marin ; Öchsner, Andreas ; El Moutea, OmarContinuum mechanics and thermodynamics, 2024, Vol.36 (1), p.197-215 [Periódico revisado por pares]Berlin/Heidelberg: Springer Berlin HeidelbergTexto completo disponível |
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Material Type: Artigo
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Ab initio prediction of structuring/mesoscale inhomogeneities in surfactant-free microemulsions and hydrogen-bonding-free microemulsionsHahn, Maximilian ; Krickl, Sebastian ; Buchecker, Thomas ; Jošt, Gašper ; Touraud, Didier ; Bauduin, Pierre ; Pfitzner, Arno ; Klamt, Andreas ; Kunz, WernerPhysical chemistry chemical physics : PCCP, 2019-04, Vol.21 (15), p.8054-8066 [Periódico revisado por pares]England: Royal Society of ChemistryTexto completo disponível |