13 IMPLICIT DOUBLE PRECISION(a-
h, o-
z)
17 common/
pydat1/mstu(200),paru(200),mstj(200),parj(200)
18 common/
pydat2/kchg(500,4),pmas(500,4),parf(2000),vckm(4,4)
21 common/
pyint2/iset(500),kfpr(500,2),coef(500,20),icol(40,4,2)
24 dimension
pp(15,4),clr(8,8),fm(10,10),rm(8,8),dx(8)
32 pq=pmas(
pycomp(kfpr(isub,2)),1)
45 pms1=spq+
pp(1,1)**2+
pp(1,2)**2
46 pms2=spq+
pp(2,1)**2+
pp(2,2)**2
47 pms3=sph+
pp(3,1)**2+
pp(3,2)**2
49 pp(3,3)=pmt3*sinh(
vint(211))
50 pp(3,4)=pmt3*cosh(
vint(211))
51 pms12=(shpr-
pp(3,4))**2-
pp(3,3)**2
52 pp(1,3)=(-
pp(3,3)*(pms12+pms1-pms2)+
53 &
vint(213)*(shpr-
pp(3,4))*
vint(220))/(2d0*pms12)
55 pp(1,4)=sqrt(pms1+
pp(1,3)**2)
56 pp(2,4)=sqrt(pms2+
pp(2,3)**2)
62 pp(
i,3)=-0.5d0*shpr*(-1)**
i
106 IF(isub.EQ.121.OR.isub.EQ.181.OR.isub.EQ.186)
THEN
110 clr(
i+3,
j+3)=16d0/3d0
130 fm(1,1)=64*pq**6+16*pq**4*ph**2+32*pq**4*(x1+2*x2+x4+x9+2*
131 & x7+x5)+8*pq**2*ph**2*(-x1-x4+2*x7)+16*pq**2*(x2*x9+4*x2*
132 & x7+x2*x5-2*x4*x7-2*x9*x7)+8*ph**2*x4*x7-16*x2*x9*x7
133 fm(1,2)=16*pq**6+8*pq**4*(-2*x1+x2-2*x3-2*x4-4*x10+x9-x8+2
134 & *x7-4*x6+x5)+8*pq**2*(-2*x1*x2-2*x2*x4-2*x2*x10+x2*x7-2*
135 & x2*x6-2*x3*x7+2*x4*x7+4*x10*x7-x9*x7-x8*x7)+16*x2*x7*(x4+
137 fm(1,3)=16*pq**6-4*pq**4*ph**2+8*pq**4*(-2*x1+2*x2-2*x3-4*
138 & x4-8*x10+x9+x8-2*x7-4*x6+2*x5)-(4*pq**2*ph**2)*(x1+x4+x10
139 & +x6)+8*pq**2*(-2*x1*x2-2*x1*x10+x1*x9+x1*x8-2*x1*x5+x2**2
140 & -4*x2*x4-5*x2*x10+x2*x8-x2*x7-3*x2*x6+x2*x5+x3*x9+2*x3*x7
141 & -x3*x5+x4*x8+2*x4*x6-3*x4*x5-5*x10*x5+x9*x8+x9*x6+x9*x5+
142 & x8*x7-4*x6*x5+x5**2)-(16*x2*x5)*(x1+x4+x10+x6)
143 fm(1,4)=16*pq**6+4*pq**4*ph**2+16*pq**4*(-x1+x2-x3-x4+x10-
144 & x9-x8+2*x7+2*x6-x5)+4*pq**2*ph**2*(x1+x3+x4+x10+2*x7+2*x6
145 & )+8*pq**2*(4*x1*x10+4*x1*x7+4*x1*x6+2*x2*x10-x2*x9-x2*x8+
146 & 4*x2*x7+4*x2*x6-x2*x5+4*x10*x5+4*x7*x5+4*x6*x5)-(8*ph**2*
147 & x1)*(x10+x7+x6)+16*x2*x5*(x10+x7+x6)
148 fm(1,5)=8*pq**4*(-2*x1-2*x4+x10-x9)+4*pq**2*(4*x1**2-2*x1*
149 & x2+8*x1*x3+6*x1*x10-2*x1*x9+4*x1*x8+4*x1*x7+4*x1*x6+2*x1*
150 & x5+x2*x10+4*x3*x4-x3*x9+2*x3*x7+3*x4*x8-2*x4*x6+2*x4*x5-4
151 & *x10*x7+3*x10*x5-3*x9*x6+3*x8*x7-4*x7**2+4*x7*x5)+8*(x1**
152 & 2*x9-x1**2*x8-x1*x2*x7+x1*x2*x6+x1*x3*x9+x1*x3*x5-x1*x4*
153 & x8-x1*x4*x5+x1*x10*x9+x1*x9*x7+x1*x9*x6-x1*x8*x7-x2*x3*x7
154 & +x2*x4*x6-x2*x10*x7-x2*x7**2+x3*x7*x5-x4*x10*x5-x4*x7*x5-
156 fm(1,6)=16*pq**4*(-4*x1-x4+x9-x7)+4*pq**2*ph**2*(-2*x1-x4-
157 & x7)+16*pq**2*(-2*x1**2-3*x1*x2-2*x1*x4-3*x1*x9-2*x1*x7-3*
158 & x1*x5-2*x2*x4-2*x7*x5)-8*ph**2*x4*x7+8*(-x1*x2*x9-2*x1*x2
159 & *x5-x1*x9**2-x1*x9*x5+x2**2*x7-x2*x4*x5+x2*x9*x7-x2*x7*x5
160 & +x4*x9*x5+x4*x5**2)
161 fm(1,7)=8*pq**4*(2*x3+x4+3*x10+x9+2*x8+3*x7+6*x6)+2*pq**2*
162 & ph**2*(-2*x3-x4+3*x10+3*x7+6*x6)+4*pq**2*(4*x1*x10+4*x1*
163 & x7+8*x1*x6+6*x2*x10+x2*x9+2*x2*x8+6*x2*x7+12*x2*x6-8*x3*
164 & x7+4*x4*x7+4*x4*x6+4*x10*x5+4*x9*x7+4*x9*x6-8*x8*x7+4*x7*
165 & x5+8*x6*x5)+4*ph**2*(-x1*x10-x1*x7-2*x1*x6+2*x3*x7-x4*x7-
166 & x4*x6)+8*x2*(x10*x5+x9*x7+x9*x6-2*x8*x7+x7*x5+2*x6*x5)
167 fm(1,8)=8*pq**4*(2*x3+x4+3*x10+2*x9+x8+3*x7+6*x6)+2*pq**2*
168 & ph**2*(-2*x3-x4+2*x10+x7+2*x6)+4*pq**2*(4*x1*x10-2*x1*x9+
169 & 2*x1*x8+4*x1*x7+8*x1*x6+5*x2*x10+2*x2*x9+x2*x8+4*x2*x7+8*
170 & x2*x6-x3*x9-8*x3*x7+2*x3*x5+2*x4*x9-x4*x8+4*x4*x7+4*x4*x6
171 & +4*x4*x5+5*x10*x5+x9**2-x9*x8+2*x9*x7+5*x9*x6+x9*x5-7*x8*
172 & x7+2*x8*x5+2*x7*x5+10*x6*x5)+2*ph**2*(-x1*x10+x3*x7-2*x4*
173 & x7+x4*x6)+4*(-x1*x9**2+x1*x9*x8-2*x1*x9*x5-x1*x8*x5+2*x2*
174 & x10*x5+x2*x9*x7+x2*x9*x6-2*x2*x8*x7+3*x2*x6*x5+x3*x9*x5+
175 & x3*x5**2+x4*x9*x5-2*x4*x8*x5+2*x4*x5**2)
176 fm(2,2)=16*pq**6+16*pq**4*(-x1+x3-x4-x10+x7-x6)+16*pq**2*(
177 & x3*x10+x3*x7+x3*x6+x4*x7+x10*x7)-16*x3*x10*x7
178 fm(2,3)=16*pq**6+8*pq**4*(-2*x1+x2+2*x3-4*x4-4*x10-x9+x8-2
179 & *x7-2*x6+x5)+8*pq**2*(-2*x1*x5+4*x3*x10-x3*x9-x3*x8-2*x3*
180 & x7+2*x3*x6+x3*x5-2*x4*x5-2*x10*x5-2*x6*x5)+16*x3*x5*(x10+
182 fm(2,4)=8*pq**4*(-2*x1-2*x3+x10-x8)+4*pq**2*(4*x1**2-2*x1*
183 & x2+8*x1*x4+6*x1*x10+4*x1*x9-2*x1*x8+4*x1*x7+4*x1*x6+2*x1*
184 & x5+x2*x10+4*x3*x4+3*x3*x9-2*x3*x7+2*x3*x5-x4*x8+2*x4*x6-4
185 & *x10*x6+3*x10*x5+3*x9*x6-3*x8*x7-4*x6**2+4*x6*x5)+8*(-x1
186 & **2*x9+x1**2*x8+x1*x2*x7-x1*x2*x6-x1*x3*x9-x1*x3*x5+x1*x4
187 & *x8+x1*x4*x5+x1*x10*x8-x1*x9*x6+x1*x8*x7+x1*x8*x6+x2*x3*
188 & x7-x2*x4*x6-x2*x10*x6-x2*x6**2-x3*x10*x5-x3*x7*x5-x3*x6*
190 fm(2,5)=16*pq**4*x10+8*pq**2*(2*x1**2+2*x1*x3+2*x1*x4+2*x1
191 & *x10+2*x1*x7+2*x1*x6+x3*x7+x4*x6)+8*(-2*x1**3-2*x1**2*x3-
192 & 2*x1**2*x4-2*x1**2*x10-2*x1**2*x7-2*x1**2*x6-2*x1*x3*x4-
193 & x1*x3*x10-2*x1*x3*x6-x1*x4*x10-2*x1*x4*x7-x1*x10**2-x1*
194 & x10*x7-x1*x10*x6-2*x1*x7*x6+x3**2*x7-x3*x4*x7-x3*x4*x6+x3
195 & *x10*x7+x3*x7**2-x3*x7*x6+x4**2*x6+x4*x10*x6-x4*x7*x6+x4*
197 fm(2,6)=8*pq**4*(-2*x1+x10-x9-2*x7)+4*pq**2*(4*x1**2+2*x1*
198 & x2+4*x1*x3+4*x1*x4+6*x1*x10-2*x1*x9+4*x1*x8+8*x1*x6-2*x1*
199 & x5+4*x2*x4+3*x2*x10+2*x2*x7-3*x3*x9-2*x3*x7-4*x4**2-4*x4*
200 & x10+3*x4*x8+2*x4*x6+x10*x5-x9*x6+3*x8*x7+4*x7*x6)+8*(x1**
201 & 2*x9-x1**2*x8-x1*x2*x7+x1*x2*x6+x1*x3*x9+x1*x3*x5+x1*x4*
202 & x9-x1*x4*x8-x1*x4*x5+x1*x10*x9+x1*x9*x6-x1*x8*x7-x2*x3*x7
203 & -x2*x4*x7+x2*x4*x6-x2*x10*x7+x3*x7*x5-x4**2*x5-x4*x10*x5-
205 fm(2,7)=8*pq**4*(x3+2*x4+3*x10+x7+2*x6)+4*pq**2*(-4*x1*x3-
206 & 2*x1*x4-2*x1*x10+x1*x9-x1*x8-4*x1*x7-2*x1*x6+x2*x3+2*x2*
207 & x4+3*x2*x10+x2*x7+2*x2*x6-6*x3*x4-6*x3*x10-2*x3*x9-2*x3*
208 & x7-4*x3*x6-x3*x5-6*x4**2-6*x4*x10-3*x4*x9-x4*x8-4*x4*x7-2
209 & *x4*x6-2*x4*x5-3*x10*x9-3*x10*x8-6*x10*x7-6*x10*x6+x10*x5
210 & +x9*x7-2*x8*x7-2*x8*x6-6*x7*x6+x7*x5-6*x6**2+2*x6*x5)+4*(
211 & -x1**2*x9+x1**2*x8-2*x1*x2*x10-3*x1*x2*x7-3*x1*x2*x6+x1*
212 & x3*x9-x1*x3*x5+x1*x4*x9+x1*x4*x8+x1*x4*x5+x1*x10*x9+x1*
213 & x10*x8-x1*x9*x6+x1*x8*x6+x2*x3*x7-3*x2*x4*x7-x2*x4*x6-3*
214 & x2*x10*x7-3*x2*x10*x6-3*x2*x7*x6-3*x2*x6**2-2*x3*x4*x5-x3
215 & *x10*x5-x3*x6*x5-x4**2*x5-x4*x10*x5+x4*x6*x5)
216 fm(2,8)=8*pq**4*(x3+2*x4+3*x10+x7+2*x6)+4*pq**2*(-4*x1*x3-
217 & 2*x1*x4-2*x1*x10-x1*x9+x1*x8-4*x1*x7-2*x1*x6+x2*x3+2*x2*
218 & x4+x2*x10-x2*x7-2*x2*x6-6*x3*x4-6*x3*x10-2*x3*x9+x3*x8-2*
219 & x3*x7-4*x3*x6+x3*x5-6*x4**2-6*x4*x10-2*x4*x9-4*x4*x7-2*x4
220 & *x6+2*x4*x5-3*x10*x9-3*x10*x8-6*x10*x7-6*x10*x6+3*x10*x5-
221 & x9*x6-2*x8*x7-3*x8*x6-6*x7*x6+x7*x5-6*x6**2+2*x6*x5)+4*(
222 & x1**2*x9-x1**2*x8-x1*x2*x7+x1*x2*x6-3*x1*x3*x5+x1*x4*x9-
223 & x1*x4*x8-3*x1*x4*x5+x1*x10*x9+x1*x10*x8-2*x1*x10*x5+x1*x9
224 & *x6+x1*x8*x7+x1*x8*x6-x2*x4*x7+x2*x4*x6-x2*x10*x7-x2*x10*
225 & x6-2*x2*x7*x6-x2*x6**2-3*x3*x4*x5-3*x3*x10*x5+x3*x7*x5-3*
226 & x3*x6*x5-3*x4**2*x5-3*x4*x10*x5-x4*x6*x5)
227 fm(3,3)=64*pq**6+16*pq**4*ph**2+32*pq**4*(x1+x2+2*x3+x8+x6
228 & +2*x5)+8*pq**2*ph**2*(-x1+2*x3-x6)+16*pq**2*(x2*x5-2*x3*
229 & x8-2*x3*x6+4*x3*x5+x8*x5)+8*ph**2*x3*x6-16*x3*x8*x5
230 fm(3,4)=16*pq**4*(-4*x1-x3+x8-x6)+4*pq**2*ph**2*(-2*x1-x3-
231 & x6)+16*pq**2*(-2*x1**2-3*x1*x2-2*x1*x3-3*x1*x8-2*x1*x6-3*
232 & x1*x5-2*x2*x3-2*x6*x5)-8*ph**2*x3*x6+8*(-x1*x2*x8-2*x1*x2
233 & *x5-x1*x8**2-x1*x8*x5+x2**2*x6-x2*x3*x5+x2*x8*x6-x2*x6*x5
234 & +x3*x8*x5+x3*x5**2)
235 fm(3,5)=8*pq**4*(-2*x1+x10-x8-2*x6)+4*pq**2*(4*x1**2+2*x1*
236 & x2+4*x1*x3+4*x1*x4+6*x1*x10+4*x1*x9-2*x1*x8+8*x1*x7-2*x1*
237 & x5+4*x2*x3+3*x2*x10+2*x2*x6-4*x3**2-4*x3*x10+3*x3*x9+2*x3
238 & *x7-3*x4*x8-2*x4*x6+x10*x5+3*x9*x6-x8*x7+4*x7*x6)+8*(-x1
239 & **2*x9+x1**2*x8+x1*x2*x7-x1*x2*x6-x1*x3*x9+x1*x3*x8-x1*x3
240 & *x5+x1*x4*x8+x1*x4*x5+x1*x10*x8-x1*x9*x6+x1*x8*x7+x2*x3*
241 & x7-x2*x3*x6-x2*x4*x6-x2*x10*x6-x3**2*x5-x3*x10*x5-x3*x7*
243 fm(3,6)=16*pq**6+4*pq**4*ph**2+16*pq**4*(-x1-x2+2*x3+2*x4+
244 & x10-x9-x8-x7-x6+x5)+4*pq**2*ph**2*(x1+2*x3+2*x4+x10+x7+x6
245 & )+8*pq**2*(4*x1*x3+4*x1*x4+4*x1*x10+4*x2*x3+4*x2*x4+4*x2*
246 & x10-x2*x5+4*x3*x5+4*x4*x5+2*x10*x5-x9*x5-x8*x5)-(8*ph**2*
247 & x1)*(x3+x4+x10)+16*x2*x5*(x3+x4+x10)
248 fm(3,7)=8*pq**4*(3*x3+6*x4+3*x10+x9+2*x8+2*x7+x6)+2*pq**2*
249 & ph**2*(x3+2*x4+2*x10-2*x7-x6)+4*pq**2*(4*x1*x3+8*x1*x4+4*
250 & x1*x10+2*x1*x9-2*x1*x8+2*x2*x3+10*x2*x4+5*x2*x10+2*x2*x9+
251 & x2*x8+2*x2*x7+4*x2*x6-7*x3*x9+2*x3*x8-8*x3*x7+4*x3*x6+4*
252 & x3*x5+5*x4*x8+4*x4*x6+8*x4*x5+5*x10*x5-x9*x8-x9*x6+x9*x5+
253 & x8**2-x8*x7+2*x8*x6+2*x8*x5)+2*ph**2*(-x1*x10+x3*x7-2*x3*
254 & x6+x4*x6)+4*(-x1*x2*x9-2*x1*x2*x8+x1*x9*x8-x1*x8**2+x2**2
255 & *x7+2*x2**2*x6+3*x2*x4*x5+2*x2*x10*x5-2*x2*x9*x6+x2*x8*x7
256 & +x2*x8*x6-2*x3*x9*x5+x3*x8*x5+x4*x8*x5)
257 fm(3,8)=8*pq**4*(3*x3+6*x4+3*x10+2*x9+x8+2*x7+x6)+2*pq**2*
258 & ph**2*(3*x3+6*x4+3*x10-2*x7-x6)+4*pq**2*(4*x1*x3+8*x1*x4+
259 & 4*x1*x10+4*x2*x3+8*x2*x4+4*x2*x10-8*x3*x9+4*x3*x8-8*x3*x7
260 & +4*x3*x6+6*x3*x5+4*x4*x8+4*x4*x6+12*x4*x5+6*x10*x5+2*x9*
261 & x5+x8*x5)+4*ph**2*(-x1*x3-2*x1*x4-x1*x10+2*x3*x7-x3*x6-x4
262 & *x6)+8*x5*(x2*x3+2*x2*x4+x2*x10-2*x3*x9+x3*x8+x4*x8)
263 fm(4,4)=64*pq**6+16*pq**4*ph**2+32*pq**4*(x1+2*x2+x3+x8+2*
264 & x6+x5)+8*pq**2*ph**2*(-x1-x3+2*x6)+16*pq**2*(x2*x8+4*x2*
265 & x6+x2*x5-2*x3*x6-2*x8*x6)+8*ph**2*x3*x6-16*x2*x8*x6
266 fm(4,5)=16*pq**6+8*pq**4*(-2*x1+x2-2*x3-2*x4-4*x10-x9+x8-4
267 & *x7+2*x6+x5)+8*pq**2*(-2*x1*x2-2*x2*x3-2*x2*x10-2*x2*x7+
268 & x2*x6+2*x3*x6-2*x4*x6+4*x10*x6-x9*x6-x8*x6)+16*x2*x6*(x3+
270 fm(4,6)=16*pq**6-4*pq**4*ph**2+8*pq**4*(-2*x1+2*x2-4*x3-2*
271 & x4-8*x10+x9+x8-4*x7-2*x6+2*x5)-(4*pq**2*ph**2)*(x1+x3+x10
272 & +x7)+8*pq**2*(-2*x1*x2-2*x1*x10+x1*x9+x1*x8-2*x1*x5+x2**2
273 & -4*x2*x3-5*x2*x10+x2*x9-3*x2*x7-x2*x6+x2*x5+x3*x9+2*x3*x7
274 & -3*x3*x5+x4*x8+2*x4*x6-x4*x5-5*x10*x5+x9*x8+x9*x6+x8*x7+
275 & x8*x5-4*x7*x5+x5**2)-(16*x2*x5)*(x1+x3+x10+x7)
276 fm(4,7)=8*pq**4*(-x3-2*x4-3*x10-2*x9-x8-6*x7-3*x6)+2*pq**2
277 & *ph**2*(x3+2*x4-3*x10-6*x7-3*x6)+4*pq**2*(-4*x1*x10-8*x1*
278 & x7-4*x1*x6-6*x2*x10-2*x2*x9-x2*x8-12*x2*x7-6*x2*x6-4*x3*
279 & x7-4*x3*x6+8*x4*x6-4*x10*x5+8*x9*x6-4*x8*x7-4*x8*x6-8*x7*
280 & x5-4*x6*x5)+4*ph**2*(x1*x10+2*x1*x7+x1*x6+x3*x7+x3*x6-2*
281 & x4*x6)+8*x2*(-x10*x5+2*x9*x6-x8*x7-x8*x6-2*x7*x5-x6*x5)
282 fm(4,8)=8*pq**4*(-x3-2*x4-3*x10-x9-2*x8-6*x7-3*x6)+2*pq**2
283 & *ph**2*(x3+2*x4-2*x10-2*x7-x6)+4*pq**2*(-4*x1*x10-2*x1*x9
284 & +2*x1*x8-8*x1*x7-4*x1*x6-5*x2*x10-x2*x9-2*x2*x8-8*x2*x7-4
285 & *x2*x6+x3*x9-2*x3*x8-4*x3*x7-4*x3*x6-4*x3*x5+x4*x8+8*x4*
286 & x6-2*x4*x5-5*x10*x5+x9*x8+7*x9*x6-2*x9*x5-x8**2-5*x8*x7-2
287 & *x8*x6-x8*x5-10*x7*x5-2*x6*x5)+2*ph**2*(x1*x10-x3*x7+2*x3
288 & *x6-x4*x6)+4*(-x1*x9*x8+x1*x9*x5+x1*x8**2+2*x1*x8*x5-2*x2
289 & *x10*x5+2*x2*x9*x6-x2*x8*x7-x2*x8*x6-3*x2*x7*x5+2*x3*x9*
290 & x5-x3*x8*x5-2*x3*x5**2-x4*x8*x5-x4*x5**2)
291 fm(5,5)=16*pq**6+16*pq**4*(-x1-x3+x4-x10-x7+x6)+16*pq**2*(
292 & x3*x6+x4*x10+x4*x7+x4*x6+x10*x6)-16*x4*x10*x6
293 fm(5,6)=16*pq**6+8*pq**4*(-2*x1+x2-4*x3+2*x4-4*x10+x9-x8-2
294 & *x7-2*x6+x5)+8*pq**2*(-2*x1*x5-2*x3*x5+4*x4*x10-x4*x9-x4*
295 & x8+2*x4*x7-2*x4*x6+x4*x5-2*x10*x5-2*x7*x5)+16*x4*x5*(x10+
297 fm(5,7)=8*pq**4*(-2*x3-x4-3*x10-2*x7-x6)+4*pq**2*(2*x1*x3+
298 & 4*x1*x4+2*x1*x10+x1*x9-x1*x8+2*x1*x7+4*x1*x6-2*x2*x3-x2*
299 & x4-3*x2*x10-2*x2*x7-x2*x6+6*x3**2+6*x3*x4+6*x3*x10+x3*x9+
300 & 3*x3*x8+2*x3*x7+4*x3*x6+2*x3*x5+6*x4*x10+2*x4*x8+4*x4*x7+
301 & 2*x4*x6+x4*x5+3*x10*x9+3*x10*x8+6*x10*x7+6*x10*x6-x10*x5+
302 & 2*x9*x7+2*x9*x6-x8*x6+6*x7**2+6*x7*x6-2*x7*x5-x6*x5)+4*(-
303 & x1**2*x9+x1**2*x8+2*x1*x2*x10+3*x1*x2*x7+3*x1*x2*x6-x1*x3
304 & *x9-x1*x3*x8-x1*x3*x5-x1*x4*x8+x1*x4*x5-x1*x10*x9-x1*x10*
305 & x8-x1*x9*x7+x1*x8*x7+x2*x3*x7+3*x2*x3*x6-x2*x4*x6+3*x2*
306 & x10*x7+3*x2*x10*x6+3*x2*x7**2+3*x2*x7*x6+x3**2*x5+2*x3*x4
307 & *x5+x3*x10*x5-x3*x7*x5+x4*x10*x5+x4*x7*x5)
308 fm(5,8)=8*pq**4*(-2*x3-x4-3*x10-2*x7-x6)+4*pq**2*(2*x1*x3+
309 & 4*x1*x4+2*x1*x10-x1*x9+x1*x8+2*x1*x7+4*x1*x6-2*x2*x3-x2*
310 & x4-x2*x10+2*x2*x7+x2*x6+6*x3**2+6*x3*x4+6*x3*x10+2*x3*x8+
311 & 2*x3*x7+4*x3*x6-2*x3*x5+6*x4*x10-x4*x9+2*x4*x8+4*x4*x7+2*
312 & x4*x6-x4*x5+3*x10*x9+3*x10*x8+6*x10*x7+6*x10*x6-3*x10*x5+
313 & 3*x9*x7+2*x9*x6+x8*x7+6*x7**2+6*x7*x6-2*x7*x5-x6*x5)+4*(
314 & x1**2*x9-x1**2*x8-x1*x2*x7+x1*x2*x6+x1*x3*x9-x1*x3*x8+3*
315 & x1*x3*x5+3*x1*x4*x5-x1*x10*x9-x1*x10*x8+2*x1*x10*x5-x1*x9
316 & *x7-x1*x9*x6-x1*x8*x7-x2*x3*x7+x2*x3*x6+x2*x10*x7+x2*x10*
317 & x6+x2*x7**2+2*x2*x7*x6+3*x3**2*x5+3*x3*x4*x5+3*x3*x10*x5+
318 & x3*x7*x5+3*x4*x10*x5+3*x4*x7*x5-x4*x6*x5)
319 fm(6,6)=64*pq**6+16*pq**4*ph**2+32*pq**4*(x1+x2+2*x4+x9+x7
320 & +2*x5)+8*pq**2*ph**2*(-x1+2*x4-x7)+16*pq**2*(x2*x5-2*x4*
321 & x9-2*x4*x7+4*x4*x5+x9*x5)+8*ph**2*x4*x7-16*x4*x9*x5
322 fm(6,7)=8*pq**4*(-6*x3-3*x4-3*x10-2*x9-x8-x7-2*x6)+2*pq**2
323 & *ph**2*(-2*x3-x4-2*x10+x7+2*x6)+4*pq**2*(-8*x1*x3-4*x1*x4
324 & -4*x1*x10+2*x1*x9-2*x1*x8-10*x2*x3-2*x2*x4-5*x2*x10-x2*x9
325 & -2*x2*x8-4*x2*x7-2*x2*x6-5*x3*x9-4*x3*x7-8*x3*x5-2*x4*x9+
326 & 7*x4*x8-4*x4*x7+8*x4*x6-4*x4*x5-5*x10*x5-x9**2+x9*x8-2*x9
327 & *x7+x9*x6-2*x9*x5+x8*x7-x8*x5)+2*ph**2*(x1*x10-x3*x7+2*x4
328 & *x7-x4*x6)+4*(2*x1*x2*x9+x1*x2*x8+x1*x9**2-x1*x9*x8-2*x2
329 & **2*x7-x2**2*x6-3*x2*x3*x5-2*x2*x10*x5-x2*x9*x7-x2*x9*x6+
330 & 2*x2*x8*x7-x3*x9*x5-x4*x9*x5+2*x4*x8*x5)
331 fm(6,8)=8*pq**4*(-6*x3-3*x4-3*x10-x9-2*x8-x7-2*x6)+2*pq**2
332 & *ph**2*(-6*x3-3*x4-3*x10+x7+2*x6)+4*pq**2*(-8*x1*x3-4*x1*
333 & x4-4*x1*x10-8*x2*x3-4*x2*x4-4*x2*x10-4*x3*x9-4*x3*x7-12*
334 & x3*x5-4*x4*x9+8*x4*x8-4*x4*x7+8*x4*x6-6*x4*x5-6*x10*x5-x9
335 & *x5-2*x8*x5)+4*ph**2*(2*x1*x3+x1*x4+x1*x10+x3*x7+x4*x7-2*
336 & x4*x6)+8*x5*(-2*x2*x3-x2*x4-x2*x10-x3*x9-x4*x9+2*x4*x8)
337 fm(7,7)=72*pq**4*x10+18*pq**2*ph**2*x10+8*pq**2*(x1*x10+9*
338 & x2*x10+7*x3*x7+2*x3*x6+2*x4*x7+7*x4*x6+x10*x5+2*x9*x7+7*
339 & x9*x6+7*x8*x7+2*x8*x6)+2*ph**2*(-x1*x10-7*x3*x7-2*x3*x6-2
340 & *x4*x7-7*x4*x6)+4*x2*(x10*x5+2*x9*x7+7*x9*x6+7*x8*x7+2*x8
342 fm(7,8)=72*pq**4*x10+2*pq**2*ph**2*x10+4*pq**2*(2*x1*x10+
343 & 10*x2*x10+7*x3*x9+2*x3*x8+14*x3*x7+4*x3*x6+2*x4*x9+7*x4*
344 & x8+4*x4*x7+14*x4*x6+10*x10*x5+x9**2+7*x9*x8+2*x9*x7+7*x9*
345 & x6+x8**2+7*x8*x7+2*x8*x6)+2*ph**2*(7*x1*x10-7*x3*x7-2*x3*
346 & x6-2*x4*x7-7*x4*x6)+2*(-2*x1*x9**2-14*x1*x9*x8-2*x1*x8**2
347 & +2*x2*x10*x5+2*x2*x9*x7+7*x2*x9*x6+7*x2*x8*x7+2*x2*x8*x6+
348 & 7*x3*x9*x5+2*x3*x8*x5+2*x4*x9*x5+7*x4*x8*x5)
349 fm(8,8)=72*pq**4*x10+18*pq**2*ph**2*x10+8*pq**2*(x1*x10+x2
350 & *x10+7*x3*x9+2*x3*x8+7*x3*x7+2*x3*x6+2*x4*x9+7*x4*x8+2*x4
351 & *x7+7*x4*x6+9*x10*x5)+2*ph**2*(-x1*x10-7*x3*x7-2*x3*x6-2*
352 & x4*x7-7*x4*x6)+4*x5*(x2*x10+7*x3*x9+2*x3*x8+2*x4*x9+7*x4*
354 fm(9,9)=-4*pq**4*x10-pq**2*ph**2*x10+4*pq**2*(-x1*x10-x2*x10+
355 & x3*x7+x4*x6-x10*x5+x9*x6+x8*x7)+ph**2*(x1*x10-x3*x7-x4*x6
356 & )+2*x2*(-x10*x5+x9*x6+x8*x7)
357 fm(9,10)=-4*pq**4*x10-pq**2*ph**2*x10+2*pq**2*(-2*x1*x10-2*x2*
358 & x10+2*x3*x9+2*x3*x7+2*x4*x6-2*x10*x5+x9*x8+2*x8*x7)+ph**2
359 & *(x1*x10-x3*x7-x4*x6)+2*(-x1*x9*x8-x2*x10*x5+x2*x8*x7+x3*
361 fmxx=-4*pq**4*x10-pq**2*ph**2*x10+2*pq**2*(-2*x1*x10-2*x2*
362 & x10+2*x4*x8+2*x4*x6+2*x3*x7-2*x10*x5+x9*x8+2*x9*x6)+ph**2
363 & *(x1*x10-x3*x7-x4*x6)+2*(-x1*x9*x8-x2*x10*x5+x2*x9*x6+x4*
365 fm(9,10)=0.5d0*(fmxx+fm(9,10))
366 fm(10,10)=-4*pq**4*x10-pq**2*ph**2*x10+4*pq**2*(-x1*x10-x2*x10+
367 & x3*x7+x4*x6-x10*x5+x9*x3+x8*x4)+ph**2*(x1*x10-x3*x7-x4*x6
368 & )+2*x5*(-x10*x2+x9*x3+x8*x4)
376 rm(7,7)=fm(7,7)-2d0*fm(9,9)
377 rm(7,8)=fm(7,8)-2d0*fm(9,10)
378 rm(8,8)=fm(8,8)-2d0*fm(10,10)
385 wtqqbh=wtqqbh+rm(
i,
j)*fac*clr(
i,
j)/(dx(
i)*dx(
j))
392 a11=-8d0*pq**4*x10-2d0*pq**2*ph**2*x10-(8d0*pq**2)*(x2*x10+x3
393 & *x7+x4*x6+x9*x6+x8*x7)+2d0*ph**2*(x3*x7+x4*x6)-(4d0*x2)*(x9
395 a12=-8d0*pq**4*x10+4d0*pq**2*(-x2*x10-x3*x9-2d0*x3*x7-x4*x8-
396 & 2d0*x4*x6-x10*x5-x9*x8-x9*x6-x8*x7)+2d0*ph**2*(-x1*x10+x3*x7
397 & +x4*x6)+2d0*(2d0*x1*x9*x8-x2*x9*x6-x2*x8*x7-x3*x9*x5-x4*x8*
399 a22=-8d0*pq**4*x10-2d0*pq**2*ph**2*x10-(8d0*pq**2)*(x3*x9+x3*
400 & x7+x4*x8+x4*x6+x10*x5)+2d0*ph**2*(x3*x7+x4*x6)-(4d0*x5)*(x3
405 a12=a12/(dx(7)*dx(8))
407 wtqqbh=-(a11+a22+2d0*a12)*8d0/9d0