Table 4.

Calculated and experimental⁶⁴,⁶⁵ densities at different concentrations of polyols in a box of water with 1100 water molecules at T = 298.15K and P = 1 atm^a or 3.5 atm^b

Compound	Molality (mol/kg)	Nsolute	Expt (g/cc)	Calc (g/cc)	% error
Mannitola	0.1999	4	1.0092	1.0228	1.35
	0.5998	12	1.0318	1.0414	0.93
	0.8006	16	1.0426	1.0503	0.74
	0.9995	20	1.0517	1.0584	0.64
Glucitola	0.5085	10	1.0117	1.0368	2.48
	1.9508	39	1.0987	1.0921	−0.60
	4.0003	79	1.1606	1.1445	−1.39
	5.9945	119	1.2052	1.1793	−2.15
Galacticolb	0.0698	2	1.0015	1.0179	1.64
	0.1492	3	1.0065	1.0202	1.36
Xylitolb	0.1000	2	1.0022	1.0165	1.43
	1.0000	20	1.0427	1.0472	0.43
	2.7000	53	1.1019	1.0925	−0.85
Erythritolb	0.4998	10	1.0142	1.0262	1.18
	1.0000	20	1.0298	1.0382	0.82
	3.0000	60	1.0806	1.0804	−0.02
Ribitolb	0.1042	2	1.0022	1.0164	1.42
	0.5092	10	1.0208	1.0315	1.05
	3.1769	63	1.1121	1.1047	−0.67
Glycerolb	0.5002	10	1.0075	1.0200	1.24
	1.0008	20	1.0171	1.0280	1.07
	3.0035	60	1.0497	1.0563	0.63
	4.9993	100	1.0750	1.0781	0.29
myo-Inositolb	0.1000	2	1.0046	1.0191	1.44
	0.2480	5	1.0163	1.0288	1.23
	0.4994	10	1.0351	1.0443	0.89
Average					0.64