. 2015 Nov 3;2:62. doi: 10.3389/fmolb.2015.00062

Table 5.

Changes in dipole moment (in Debye) upon vertical excitation to the lowest bright local excitation (LE) or to the Tyr-FMN charge transfer (CT) state.

	A w/D3BJ		A w/o D3BJ		J w/D3BJ		J w/o D3BJ
	\|μ_t\|–\|μ₀\|	\|μ_t–μ₀\|	\|μ_t\|–\|μ₀\|	\|μ_t–μ₀\|	\|μ_t\|–\|μ₀\|	\|μ_t–μ₀\|	\|μ_t\|–\|μ₀\|	\|μ_t–μ₀\|
LE, Gas phase	0.02	1.70	−0.05	4.18	0.44	1.98	0.39	1.98
LE, CPCM	0.96	2.03	1.15	2.28	1.05	2.38	0.95	2.36
CT, CPCM	28.00	33.15	27.56	33.10	24.20	31.73	24.21	31.85