2001
DOI: 10.2172/816276
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Proposal to DOE Basic Energy Sciences: Ultrafast X-ray science facility at the Advanced Light Source

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“…The sample was excited by 400 nm laser pulses with 125 mW energy at a repetition rate of 1 kHz and X-ray pulses of $70 ps width probe the transient XAS spectra at the Ru L 3 -edge. 25 DFT was used to optimize the geometric structure of [Ru (m-bpy) 3 ] 2+ with the Gaussian 09 program software package. 26 The structures of 1 A 1 and 3 dd state were fully optimized by the hybrid functional of Perdew, Burke, and Ernzerhof (PBE0) 27 with the def2-SVP basis set.…”
Section: Methodsmentioning
confidence: 99%
“…The sample was excited by 400 nm laser pulses with 125 mW energy at a repetition rate of 1 kHz and X-ray pulses of $70 ps width probe the transient XAS spectra at the Ru L 3 -edge. 25 DFT was used to optimize the geometric structure of [Ru (m-bpy) 3 ] 2+ with the Gaussian 09 program software package. 26 The structures of 1 A 1 and 3 dd state were fully optimized by the hybrid functional of Perdew, Burke, and Ernzerhof (PBE0) 27 with the def2-SVP basis set.…”
Section: Methodsmentioning
confidence: 99%