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1 |
Material Type: Artigo
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Best molecular multiple quantum bit for the diatomic molecular quantum computer using potassium nitride and calcium nitride through vibrational progressionIshii, KeisakuInternational journal of quantum chemistry, 2014-11, Vol.114 (21), p.1486-1494 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
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2 |
Material Type: Artigo
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NTChem: A high-performance software package for quantum molecular simulationNakajima, Takahito ; Katouda, Michio ; Kamiya, Muneaki ; Nakatsuka, YutakaInternational journal of quantum chemistry, 2015-03, Vol.115 (5), p.349-359 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
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3 |
Material Type: Artigo
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A quantum theory atoms in molecules investigation of Lewis base protonationda Silva, Natieli Alves ; Terrabuio, Luiz Alberto ; Haiduke, Roberto Luiz AndradeInternational journal of quantum chemistry, 2017-02, Vol.117 (3), p.197-207 [Periódico revisado por pares]Hoboken: Wiley Subscription Services, IncTexto completo disponível |
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4 |
Material Type: Artigo
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Automatic code generation for quantum chemistry applicationsMazur, Grzegorz ; Makowski, Marcin ; Łazarski, Roman ; Włodarczyk, Radosław ; Czajkowska, Ewa ; Glanowski, MichałInternational journal of quantum chemistry, 2016-09, Vol.116 (18), p.1370-1381 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |
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5 |
Material Type: Artigo
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The force matching approach to multiscale simulations: Merits, shortcomings, and future perspectivesMasia, Marco ; Guàrdia, Elvira ; Nicolini, PaoloInternational journal of quantum chemistry, 2014-08, Vol.114 (16), p.1036-1040 [Periódico revisado por pares]Hoboken: Blackwell Publishing LtdTexto completo disponível |