Preliminary Assessment of the First-Order Density Matrix in Quantum Monte Carlo from Density Matrix Theory von Angelotti, Wagner F. D., Politi, José R. S., Custodio, Rogério

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BTEX adsorption on TiO2 anatase and rutile surfaces: DFT functionals von dos Reis Vargas, Marcos, de Castro, Elton A. S., Politi, José R. dos S., Gargano, Ricardo, Martins, João B. L.

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Computational analysis of vibrational frequencies and rovibrational spectroscopic constants of hydrogen sulfide dimer using MP2 and CCSD(T) von Martins, João B.L., Quintino, Rabeshe P., Politi, José R. dos S., Sethio, Daniel, Gargano, Ricardo, Kraka, Elfi

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Theoretical Study of CH4−CH4, CHF3−CH4, CH4−H2O, and CHF3−H2O Dimers von Martins, João B. L, Politi, José R. S, Garcia, Edgardo, Vilela, Alessandra F. A, Gargano, Ricardo

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Methanol, ethanol, propanol, and butanol adsorption on H-ZSM-5 zeolite: an ONIOM study von Costa, Rogério J., Castro, Elton A. S., Politi, José R. S., Gargano, Ricardo, Martins, João B. L.

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ONIOM study of dissociated hydrogen and water on ZnO surface von Martins, João B. L., Taft, Carlton A., Longo, Elson, de Castro, Elton A. S., da Cunha, Wiliam F., Politi, José R. S., Gargano, Ricardo

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Rovibrational energy and spectroscopic constant calculations of CH4⋯CH4, CH4⋯H2O, CH4⋯CHF3, and H2O⋯CHF3 dimers von Cunha, Wiliam F, Gargano, Ricardo, Garcia, Edgardo, Politi, José R S, Albernaz, Alessandra F, Martins, João B L

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Lateral interaction and spectroscopic constants of CO adsorbed on ZnO von de Lima, Ítalo P., Politi, José R. dos S., Gargano, Ricardo, Martins, João B. L.

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BTEX adsorption on TiO 2 anatase and rutile surfaces: DFT functionals von Dos Reis Vargas, Marcos, de Castro, Elton A S, Politi, José R Dos S, Gargano, Ricardo, Martins, João B L

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Rovibrational energy and spectroscopic constant calculations of CH 4 ⋯ CH 4, CH 4 ⋯ H 2 O, CH 4 ⋯ CHF 3, and H 2 O ⋯ CHF 3 dimers von Cunha, Wiliam F., Gargano, Ricardo, Garcia, Edgardo, Politi, José R. S., Albernaz, Alessandra F., Martins, João B. L.

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Rovibrational energy and spectroscopic constant calculations of CH 4 ⋯ CH4, CH 4 ⋯ H2 O, CH 4 ⋯ CHF3, and H 2O ⋯ CHF3 dimers von Cunha, Wiliam F., Gargano, Ricardo, Garcia, Edgardo, Politi, José R. S., Albernaz, Alessandra F., Martins, João B. L.

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Theoretical Study of CH 4 −CH 4 , CHF 3 −CH 4 , CH 4 −H 2 O, and CHF 3 −H 2 O Dimers von Martins, João B. L., Politi, José R. S., Garcia, Edgardo, Vilela, Alessandra F. A., Gargano, Ricardo

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Theoretical studies on the stability of N-methylformamide in both liquid and gas phases von Cordeiro, João M.M., Cordeiro, Maria A.M., Bôsso, Antônio R.S.A., Politi, José R.S.

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Synthesis, structure and properties of the mixed-ligand tungsten(II) complex [WBr 2(CO) 3(tmpymt)] (tmpymt = 1,4,6-trimethylpyrimidine-2-thione) von Falcomer, Viviane A.S., Lemos, Sebastião S., Politi, José R.S., Casagrande, Gleison A., Lang, Ernesto S., Burrow, Robert A.

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Peptide:lipid ratio and membrane surface charge determine the mechanism of action of the antimicrobial peptide BP100. Conformational and functional studies von Manzini, Mariana C., Perez, Katia R., Riske, Karin A., Bozelli, José C., Santos, Talita L., da Silva, Marcia A., Saraiva, Greice K.V., Politi, Mario J., Valente, Ana P., Almeida, Fábio C.L., Chaimovich, Hernan, Rodrigues, Magali A., Bemquerer, Marcelo P., Schreier, Shirley, Cuccovia, Iolanda M.

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The dicrotic notch analyzed by a numerical model von Politi, María Teresa, Ghigo, Arthur, Fernández, Juan Manuel, Khelifa, Ismaïl, Gaudric, Julien, Fullana, José María, Lagrée, Pierre-Yves

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Parameter estimation to study the immediate impact of aortic cross‐clamping using reduced order models von Ventre, Jeanne, Politi, M. Teresa, Fernández, Juan M., Ghigo, Arthur R., Gaudric, Julien, Wray, Sandra A., Lagaert, Jean‐Baptiste, Armentano, Ricardo, Capurro, Claudia, Fullana, José Maria, Lagrée, Pierre‐Yves

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In-Hospital influenza vaccination to prevent cardiorespiratory events in the first 45 days after acute coronary syndrome: A prespecified analysis of the VIP-ACS trial von Fonseca, Henrique Andrade R., Zimerman, André, Monfardini, Frederico, Guimarães, Hélio Penna, Pedrosa, Rodrigo P., Patriota, Rodrigo de Lemos S., Couto Patriota, Tarcya L.G., Passos, Luiz Carlos Santana, Dall'Orto, Frederico Toledo Campo, Hoffmann Filho, Conrado Roberto, Nascimento, Bruno Ramos, Baldissera, Felipe Antônio, Pereira, Cesar A.C., Caramori, Paulo Ricardo Avancini, Andrade, Pedro Beraldo, Okoshi, Marina Politi, Polanczyk, Carisi Anne, Silveira, Fabio Serra, Villacorta, Aline Sterque, Nicolau, José Carlos, Rizzo, Luiz V., Berwanger, Otávio

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Gaps in HIV and Hepatitis C Testing Among 3486 HIV-Negative Men Who have Sex with Men in Spain in the Era of Highly Effective Antiviral Therapies von Politi, Julieta, Donat, Marta, Guerras, Juan Miguel, Ayerdi, Oskar, Palma, David, García, Jorge Néstor, Barrio, Gregorio, Belza, María José

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Maize replacement with sorghum and a combination of protease, xylanase, and phytase on performance, nutrient utilization, litter moisture, and digestive organ size in broiler chick... von Pasquali, G.A.M., Fascina, V.B., Silva, A.L., Aoyagi, M.M., Muro, E.M., Serpa, P.G., Berto, D.A., Saldanha, E.S.P.B., Sartori, J.R.

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