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Khi lng ring dCu = 4 (63,5 / 6,02. 1023) / (3,61. 10-8)3 = 8,98 g/cm3
Theo ph lc dCu = 8,96 g/cm3
3) Tnh mt thng ca nguyn t theo phng [110] ca Cu (Fcc).
Gii: Mt thng = s nguyn t / chiu di (cm)
2
2
( Linear density ) LD =
=
= 3,9 x 10 7 ngtu / cm
8
a 2 (3,61.10 ) 2
4) Tnh lp li trn phng [211] ca Cu (Fcc).
lp li theo mt phng (Repetition spacing) = khong cch gia cc nguyn t trn phng .
Phng [211]: ng thng ni t gc O n im (1, 1/2, 1/2) : im K gia ca mt ABCD.
K [211]
A
a/2
[110]
O
A a/2 M B
OK =
a2 +
a 2 a 2 a 6 3,61 6
+
=
=
= 4,43A 0
4
4
2
2
aPb =
4r
2
nS (100) =
S = a2
4(1,750)
2
= = 4,95 A
1
x 4 + 1 = 2 nguyn t
4
PD (100) =
-7
(4,95 x 10 mm )
1
1
nS (111) = x 3 = nguyen t
6
2
1
3r
S = bh = 2r .
= 3r 2
2
2
1
1
2
PD (111) = 2 2 =
= 0,095 nguyn t / A2 = 9,5. 1012 nguyn t / mm2
2
3r
3.(1,75)
4,95
h2 + k 2 + l 2
22 + 02 + 02
4,95
4,95
=
= 2,86 A0
2
2
2
3
1 +1 +1
4,95
= 2,475 A0
2
7) St thay i t Bcc sang Fcc 9100 C. nhit ny, bn knh nguyn t ca st trong hai cu trc
l 1,258 A0 (Bcc) v 1,292 A0 (Fcc). Tnh % th tch thay i.
Gii: C s tnh : 4 nguyn t Fe, hoc 2 c s ca Fe (Bcc) (n / c s = 2)
hoc 1 c s ca Fe (Fcc) (n / c s = 4)
4
x
1
,
258
i vi Bcc V0 = 2a3 = 2 [
]3 = 49,1 A3
3
4
x
1
,
292
Fcc V1 = a3 = [
]3 = 48,7 A3
2
V V0
48,7 49,1
V = 1
.100% =
x 100% = 0,8%
V0
49,1
8) Hp kim cha 80% khi lng Al v 20 % khi lng Mg. Tnh % nguyn t mi loi.
Gii: C s tnh
100g hp kim
Al
Mg
80g Khi lng mi nguyn t 20g
S nguyn t mi nguyn t
80 x (6,02.1023 )
26,98
= 2,97 x 6,02.1023
khoi lng
20
x So Avogadro )
x (6,02.1023 )
nguyen t gam
24,3
g
x nguyen t /mol )
g/mol
2,97 x 6,02.1023
x 100% = 78%
3,793 x 6,02.1023
0,823 x 6,02.1023
3,793 x 6,02.1023
x 100% = 22%
9) Trong cu trc MgO, cc ion Mg2+ b thay th bi Fe2+ theo t l Mg2+ / Fe2+ = 17 / 10. Tnh t s
khi lng MgO / FeO.
Gii:
Mg2 +
Fe
2+
17
= t s mol
10
AN : S Avogadro
10) Khi lng ring thc t ca Al n tinh th l 2,679 g/cm3. Hng s mng a = 4,049 A0 (Al : Fcc).
Nu s khc nhau gia khi lng ring thc t v tnh ton l do s c mt cc l trng trong tinh th.
a) Tnh phn nguyn t b b trng.
b) Tnh s l trng trn 1cm3.
Gii: S nguyn t thc t / 1 cm3 =
2,697
23
= 6,02. 1022
nguyen t
(26,98) / (6,02.10 )
cm 3
So nguyen t / O c s
4
nguyen t
S v tr ca nguyn t / 1cm3 =
=
= 6,03. 1022
8
3
The tch o c s
(4,049.10 )
cm 3
3
22 nguye n t
22
3
0,0110
. 22
22
6,02.10
cm 3
= 0,01.10 ch trng / cm
1
C 600 v tr s c 1 v tr b b trng.
600
a) cn bng in tch 2
(Fe 3+ ) (Fe2 + )
V/ / 2+
Fe
2 Fe 1 trng Fe
3+
2+
100
50
= 50 ion Fe3+
= 25 v tr trng Fe2+
2
2
2800 / AN
= 0,251
(2800 + 8370) / AN
1
1
x 8 + x 6 = 4 , nF = 8
8
2
8 x 19 + 4 x 40,08
b) Khi lng 1 c s =
6,02 x 10
23
= 5,2 x 10 22 g
S mol Li2O =
2 M Li + M O
0,2
-3
= 6,7.10 mol
2 x 6,941 + 16
-3
g MgO
M Mg + M O
99,8
= 2,4758 mol
24,31 + 16
N Li 2 x 6,7.10 3
=
= 6,7.10-3 mol
2
2
N ov 6,7.10
=
= 1,34.10 3
4,9759
NT
Q
Q
Q 1
Q 1
) = 2 exp(
) (
) = ln 2 (
)
R.308
R.298
R 308
R 298
Q
1
Q
Q 1
Q 1
exp() = exp(
) ( ) = ln 2 (
)
RT
R.298
R T
R 298
2
exp(-
(3)
(4)
+ =
R 308 T
R 298
308 T 298
T = 288,6 0K = 15,6 0C
16) Gi s c ion X3+ thay th Mg2+ trong MgO
a) Vit phng trnh cu trc cho s thay th
b) Nu t l X3+ / Mg2+ = 0,25. Tnh t l cation / anion
//
2 X Mg = VMg
100 Mg2+ 25 X3+ 12,5 VMg Tng s cation 125 (khng phi tng s v tr cation)
100 Mg2+ 100 O225 X3+ 37,5 O2cation 125
Tng anion = 137,5 T s
=
= 0,91
anion 137,5
17) 1000 0C c 1,7% kl Cacbon to dung dch rn vi Fe (Fcc) S c bao nhiu nguyn t C cho
100 c s.
Fe(Fcc) nFe/ = 4 100 = 400 nguyn t Fe
55,85
Khi lng 400 nguyn t = 400 x
AN
55,85 100 22726
Khi lng 100 = 400 x
x
=
AN 98,3
AN
S nguyn t Cacbon
22726
1,7
AN
= 32
x
x
AN
100 12,01
18) Mng khuyt tt Fe(1-x)O c cu trc ging NaCl, ngoi tr vi v tr trng ion Fe2+ v c mt vi
phn Fe3+ thay th Fe2+. Trong x= 0,04 0,16 ty thuc vo nhit v lng oxy c sn. Nu
mng ny cha 52% nguyn t oxy v c hng s mng l 0,429 nm.
a) Tnh t s Fe2+ / Fe3+
b) Tnh khi lng ring.
C s tnh 100 nguyn t = 52 nguyn t oxy v 48 nguyn t Fe
2 (Fe 3+ )(Fe2 + ) = V / / 2 +
Fe
Ha tr Fe2+
y = 8
Fe3+= 8
Fe2+ = 40
Fe2+ / Fe3+ = 5
19) CaF2 c khi lng ring ban u l d0, sau khi c mt trt t th c khi lng ring l d1. Bit
MCa = 40; MAl = 27; MSr = 87,62; MY = 88,91; MF = 19. Nu d1 < d0 th l do nguyn nhn no di
y:
a) mt trt t kiu Frenkel anion
b) mt trt t kiu Schottky
c) khi Sr2+ thay ch Ca2+
d) Thm YF3 vo CaF2 sao cho Y3+ thay ch Ca2+, F (trong YF3) v tr xen k
e) Thm AlF3 vo CaF2 sao cho Al3+ thay ch Ca2+, trng Ca2+
4 x 40 + 8x19
Gii: d 0 =
ANxV
a) Mt trt t kiu Frenkel anion: to F- v tr xen k v trng F, nh vy s ion F trong mt
khng i, nn d1 = do
b) Mt trt t kiu Schottky: trng Ca v trng F, nh vy s ion Ca v F trong mt u gim, nn
d1 < do
c) Sr2+ thay ch Ca2+: khng to in tch d, MSr > MCa nn d1 > do
d) Y3+ thay ch Ca2+, F (trong YF3) v tr xen k: (Y3+).(Ca2+) = Fi
Do MY > MCa v s ion F trong mt tng ln, nn d1 > do
e) Al3+ thay ch Ca2+, trng Ca2+: 2(Al3+).(Ca2+) = V(Ca2+)
Nh vy c 2 Al3+ i vo, s c 3 Ca2+ i ra.
e) 2 x 27 < 3 x 40 nn d1 < do
Tm li nu d1 < do th l do a) v e)
20) Nu ng sut tip ti hn trn phng [1 1 0] v trn mt (111) ca n tinh th Cu nguyn cht l
142 psi (0,1 kg/ mm2), th ng sut p dng trn phng [100] l bao nhiu to ra trt trn mt
(111)
Cch 1: Dng hnh hc
n[111]
1
hang so mang
a
=
=
= 0,577
ng cheo khoi a 3
3
1
hang so mang
a
cos =
=
=
= 0,707
ng cheo mat a 2
2
142
=
=
= 350 psi
cos cos 0,707 x 0,577
cos =
[100]
=?
[110]
1 x 1+ 0 x 1+ 0 x 1
1 +0 +0
1 +1 +1
1
3
= 0,577
1 x 1+ 0 x (-1) + 0 x 0
12 + 02 + 02 12 + (1)2 + 02
Tnh nh cch 1
1
2
= 0,707
II PHN BI TP
1) in vo bng, quan h gia bn knh nguyn t r v cc kch thc ca c s i vi Bcc, Fcc
v Lp phng n gin (ch c 8 nguyn t trn 8 nh ca hnh lp phng).
Bcc
Fcc
LP
Hng s mng a
ng cho mt
ng cho khi
2) Ag (Fcc) c r = 1,444 A0. Tnh hng s mng v th tch c s.
3) Au (Fcc) c a = 4,078 A0, Nguyn t lng 197. Tnh khi lng ring ca n.
4) Zn (Hcp) c c = 4,94 A0, khong cch gia tm 2 nguyn t k nhau trn mt y c s l 2,665
A0. Tnh: a) S nguyn t / c s b) Th tch c s c) Tnh khi lng ring
S: a) 6
b) 9,1.10-23 cm3 c) 7,16 g / cm3
5) Nguyn t lng ca Na l 22,990 v Cl l 35,453. Nu khi lng ring l 2,165 g / cm3. Tnh: a)
Hng s mng a b) ng cho mt c) ng cho khi ca c s NaCl.
S: a) 5,64 A0
b) 7,89 A0
c) 9,77 A0
6) Tinh mt phng ca nguyn t theo phng [112] ca: a) Fe (Bcc) c rFe = 1,241 A0 b) Ni (Fcc)
c rNi = 1,245 A0.
S: a) 1,42.107 nguyn t / cm b) 2,32.107 nguyn t / cm
7) Tnh mt phng ca Cu (Fcc), rCu = 1,278 A0 trn mt a) (100), b) (110) c) (111)
S: a) 1,53.1013 nguyn t /mm2 b) 1,08.1013 nguyn t / mm2 c) 1,77.1013 nguyn t / mm2
8) Al (Fcc) c a = 4,049 A0. Tnh a) d220 b) d111
S: a) 1,432 A0
b) 2,338 A0
c) 2,025 A0
c) d200
9) Khong cch gia cc mt (110) trong cu trc Bcc ca mt kim loi l 2,03 A0. a) Tnh hng s
mng a b) Tnh bn knh nguyn t. c) Kim loi l kim loi no (Tra t khi lng nguyn t)
S: a) 2,87 A0 b) 1,243 A0 c) Fe (Bcc) hoc Ni
10) MgO c cu trc ging NaCl, khi lng ring ca n l 3,65 g / cm3. Tnh kch thc c s a v
2+
kim tra li vi rMg
= 0,78A0, R O2 = 1,32A0.
11) Titan c cu trc Hcp vi a = 2,965 A0, c = 4,683 A0 nhit < 880 0C v s c cu trc Bcc vi
a = 3,32 A0 nhit > 880 0C.
a) Mng Ti s dn ra hay co li khi un nng n n 900 0C.
b) Tnh thay i th tch theo cm3 /g.
S: a) mng s dn ra b) 0,007 cm3 / g.
12) Na (Bcc) c a = 4,29 A0. Biu din s sp xp nguyn t (mt cch gn ng) trn mt (110) v
tnh khong cch gia cc mt ny.
13) Kim cng c hng s mng a = 3,56 A0. Tnh: a) Mt xp th tch b) Khi lng ring ca
kim cng.
S: a) 33,9 %
b) 3,54 g / cm3.
14) Tnh s nguyn t trong mt mu hnh tr ly trn mt ng rn (Cu c khi lng ring 8,93
g/cm3, nguyn t lng 63,55), bit mu c ng knh 1 m v dy 1 m.
S: 6,64.1010 nguyn t.
15) Mt mol ca MgO rn chim mt khi vung c cnh l 22,37 mm. Tnh khi lng ring ca
MgO (MMg = 24,31; MO = 16). S: 3,60 g / cm3
16) Mt hp kim cha 85% khi lng Cu v 15 % kl Sn. Tnh % nguyn t mi loi. Bit MCu =
63,55; MSn = 118,69.
S: 8,63 % Sn, 91,37 % Cu.
17) C 5% nguyn t Mg trong hp kim Al-Mg. Tnh % Khi lng Mg v Al. Bit MMg = 24,31; MAl
= 26,98.
S: 4,53 % kl Mg v 95,47 % kl Al.
18) Hp kim cha 75% kl Cu v 25% kl Zn. Bit MCu = 63,55; MZn = 65,37.
a) Tnh % nguyn t mi loi. b) Loi pha ca hp kim v loi cu trc ca c s. c) Tnh khi lng
1 c s ca hp kim. d) Bit khi lng ring ca hp kim l 8,5 g/cm3, tnh th tch c s. e) Tnh
hng s mng trung bnh ca c s.
S: a) 75,53 % nguyn t Cu, 24,47 % Zn b) Dd rn, Fcc ca ng
c) 4,25.10-22 g d) 5.10-23 cm3 e) 3,68 A0
19) Dung dch rn xen k ca Fe cha C theo t l C: Fe = 33:108. Tnh % khi lng Cacbon c mt
trong dung dch rn. S: 6,2 % Cacbon.
20) Hp kim cha 80% kl Ni v 20% Cu to dd rn thay th (Fcc) vi a = 3,54A0. Bit MCu = 63,55;
MNi = 58,71. Tnh khi lng ring ca hp kim. S: 8,923 g / cm3.
21) Nu 1% khi lng Cacbon c trong Fe (Fcc), tnh phn trm cc c s c cha cacbon. Gi s
mi c s ch cha ti a 1 nguyn t Cacbon.
S: 19% c s c cha cacbon
22) Tm bn knh nguyn t ln nht c th nm khe h ca Fe m khng gy ra ng sut ni (do sai
lch mng) a) i vi Fe (Bcc) b) i vi Fe (Fcc)
Gi : Tm l hng ln nht Bcc (
S: a) r (l) = 0,37 A0
1 1
1 1 1
, ,0) , Fcc ( , , )
2 4
2 2 2
b) r(l) = 0,54 A0
BI TP LM THM
1) Si (c cu trc ging kim cng, a = 0,543 nm) cha 1021 nguyn t B trong 1 m3 to bn dn
loi p. Tnh phn trm khi lng ca B v s c s Si c cha 1 nguyn t B. Bit MSi = 28,09, MB
= 10,81.
10
2) Bit CaF2 c rCa = 0.106 nm v RF = 0,133 nm. Hy xc nh : a) Hnh chiu trn mt phng y
ca CaF2 v mt xp th tch ca khi lp phng to bi 8 ion F-. b) Mt xp ca mt mt
phng ch cha ion dng. c) Mt xp ca mt mt phng ch cha ion m.
3) 912 0C th tch c s ca Fe (Bcc) l 0,02464 nm3 v ca Fe (Fcc) l 0,0486 nm3. Tnh phn
trm thay i khi lng ring khi Fe chuyn t Bcc sang Fcc. Bit MFe = 55,85.
4). Bit bn knh r (Ni2+) = 0,078 nm, r (O2-) = 0,132 nm, hy d on cu trc, biu din hnh chiu
trn mt phng ngang v tnh mt sp xp th tch ca NiO.
5) Nu CaF2 (khng c khuyt tt) c thay th Ca2+ bi Y3+ vi t l Y3+/ Ca2+ = 0.1. Tnh khi
lng ring CaF2 khi c YF3. Bit MCa = 40, MY = 88,91, MF = 19 , rCa = 0,106 nm v RF = 0,133
nm
Gi s khi thm YF3 vo CaF2 th khng to ra ion xen k v hng s mng CaF2 vn khng i.
6) Si (c cu trc ging kim cng, a = 0,543 nm) cha 0,000 001 % khi lng P to bn dn loi
n. Tnh s nguyn t P trong 1 m3 Si v s c s Si c cha 1 nguyn t P. Bit MSi = 28,09, MP=
30,97.
7) Bit ZnS (sphalerite) c rZn = 0,083 nm v RS = 0,174 nm. Hy xc nh : a) Hnh chiu trn mt
phng y v khong cch gn nht gia hai ion dng. b) Mt xp ca mt mt phng ch cha ion
dng. c) Mt xp ca mt mt phng ch cha ion m.
8) MnS c hai dng cu trc, mt dng vi cu trc ging NaCl { r ( Mn2+) = 0,083 nm, r (S2-) = 0,174
nm}, mt dng ging vi ZnS (sphalerite) { r ( Mn2+) = 0,068 nm, r (S2-) = 0,164 nm}. Tnh phn trm
thay i th tch khi dng ZnS chuyn thnh dng NaCl.
9) Bit bn knh r(Cs+) = 0,167 nm, r(I-) = 0,22 nm, hy d on cu trc, biu din hnh chiu trn mt
phng ngang v tnh mt sp xp th tch ca CsI.
10) Mng KCl (ging NaCl, khng c khuyt tt) c thay th K+ bi Ti4+ vi t l Ti4+/ K+ = 0.1.
Tnh khi lng ring KCl khi c TiCl4. Bit MK = 39, MTi = 47,9, MCl = 35,5, rK = 0,133 nm v RCl =
0,181 nm
Gi s khi thm TiCl4 vo KCl th khng to ra ion xen k v hng s mng KCl vn khng i.
11) 1000 0 C c 1,7 % khi lng cacbon to dung dch rn vi Fe (Fcc) . Tnh s nguyn t cacbon
trong 100 c s ca st. MFe = 55,85 v MC = 12,01.
12) Bit CsCl c rCs = 0,165 nm v RCl = 0,181 nm. Hy xc nh : a) Hnh chiu trn mt phng y
v khong cch t gc n mt (112). b) Mt xp ca mt mt phng ch cha ion dng. c) Mt
xp ca mt mt phng ch cha ion m.
13) Hng s mng ca kim cng a = 0,357 nm. Tnh phn trm thay i th tch khi 1 g kim cng
chuyn thnh 1 g grapht, bit khi lng ring ca grapht l 2,25 g/cm3. Bit MC = 12,01.
14) Bit bn knh r (Mg2+) = 0,066 nm, r (O2-) = 0,132 nm, hy d on cu trc, biu din hnh chiu
trn mt phng ngang v tnh mt sp xp th tch ca MgO.
11
15) Mng NaCl (khng c khuyt tt) c thay th Na+ bi Al3+ vi t l Al3+/ Na+ = 0.1. Tnh
khi lng ring NaCl khi c AlCl3 . Bit MNa = 23, MAl = 27, MCl = 35,5, rNa = 0.098 nm v RCl =
0,181 nm
Gi s khi thm AlCl3 vo NaCl th khng to ra ion xen k v hng s mng NaCl vn khng i
16) Ni c cu trc Fcc vi MNi = 58,71, khi lng ring theo l thuyt ca Ni l 8,91 g/cm3 v khi
lng ring thc t l 8,87 g/cm3. Nu s khc nhau v khi lng ring l do s c mt ca nt trng,
hi c bao nhiu v tr nguyn t th c mt v tr b b trng.
17) Bit NaCl c rNa = 0,098 nm v RCl = 0,181 nm. Hy xc nh : a) Hnh chiu trn mt phng y
1
2
1
2
v khong cch gia hai ion dng (0,1,0) v ( ,0, ). b) Mt xp ca mt mt phng ch cha
ion dng. c) Mt xp ca mt mt phng ch cha ion m.
18) MnS c hai dng cu trc, mt dng vi cu trc ging NaCl { r ( Mn2+) = 0,083 nm, r (S2-) =
0,174 nm}, mt dng ging vi ZnS (sphalerite) { r ( Mn2+) = 0,048 nm, r (S2-) = 0,158 nm}. Tnh phn
trm thay i th tch khi dng NaCl chuyn thnh dng ZnS.
19) Bit bn knh r (Cd2+) = 0,069 nm, r (S2-) = 0,174 nm, hy d on cu trc, biu din hnh chiu
trn mt phng ngang v tnh mt sp xp th tch ca CdS.
20) MnS dng NaCl c rMn2+ = 0.91 A v RS2- = 1.74 A . MMn = 55, MS = 32.
a) Ghi gi tr ta z trn hnh v, tnh khi lng ring v mt xp th tch Mv.
b) Tnh MS(220) v MS(111).
Mn2+
S2
21) Co c cu trc lc gic xp cht (Hcp) vi khi lng ring = 8,83 g/cm3 , nguyn t lng MCo
= 58,93 v t s c/a = 1,62. Hy tnh hng s mng a, c v bn knh nguyn t Co. So snh vi gi tr
bn knh nguyn t Co l 0,125 nm trong s tay.
22) Mt nt trng trong Cu tnh theo Cv = exp (-Q/RT). Bit Q = 83600 J/mol, R = 8,31 J/mol.oK.
Khi Cu chuyn t nhit phng (25 oC) sang nhit chy (1083 oC) th mt nt trng s tng ln
bao nhiu ln